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Isocumarinas

Compuestos orgánicos bicíclicos aromáticos que están formados por un anillo de benceno fusionado a un anillo de furano; también conocidos como ftalatos.
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1 – 13 de 13 resultados
1

Ftalano, 98 %, Thermo Scientific Chemicals

CAS: 496-14-0 Fórmula molecular: C8H8O Peso molecular (g/mol): 120.151 Número MDL: MFCD00005932 Clave InChI: SFLGSKRGOWRGBR-UHFFFAOYSA-N Sinónimo: phthalan,1,3-dihydroisobenzofuran,isocoumaran,isobenzofuran, 1,3-dihydro,o-xylylene oxide,2-oxaindan,1,3-dihydro isobenzofuran,unii-2r6ntq7y6g,ccris 1557,2r6ntq7y6g PubChem CID: 10327 Nombre IUPAC: 1,3-dihidro-2-benzofurano SMILES: C1C2=CC=CC=C2CO1

Sinónimo phthalan,1,3-dihydroisobenzofuran,isocoumaran,isobenzofuran, 1,3-dihydro,o-xylylene oxide,2-oxaindan,1,3-dihydro isobenzofuran,unii-2r6ntq7y6g,ccris 1557,2r6ntq7y6g
Clave InChI SFLGSKRGOWRGBR-UHFFFAOYSA-N
PubChem CID 10327
Fórmula molecular C8H8O
CAS 496-14-0
Peso molecular (g/mol) 120.151
Número MDL MFCD00005932
SMILES C1C2=CC=CC=C2CO1
Nombre IUPAC 1,3-dihidro-2-benzofurano
2

Tofogliflozin, TRC

CAS: 903565-83-3 Fórmula molecular: C22 H26 O6 Peso molecular (g/mol): 386.44 Sinónimo: (1S,3'R,4'S,5'S,6'R)-6-[(4-Ethylphenyl)methyl]-3',4',5',6'-tetrahydro-6'-(hydroxymethyl)spiro[isobenzofuran-1(3H),2'-[2H]pyran]-3',4',5'-triol,CSG 452 Nombre IUPAC: (3'R,4'S,5'S,6'R)-5-[(4-ethylphenyl)methyl]-6'-(hydroxymethyl)spiro[1H-2-benzofuran-3,2'-oxane]-3',4',5'-triol SMILES: CCc1ccc(Cc2ccc3COC4(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3c2)cc1

Sinónimo (1S,3'R,4'S,5'S,6'R)-6-[(4-Ethylphenyl)methyl]-3',4',5',6'-tetrahydro-6'-(hydroxymethyl)spiro[isobenzofuran-1(3H),2'-[2H]pyran]-3',4',5'-triol,CSG 452
Fórmula molecular C22 H26 O6
CAS 903565-83-3
Peso molecular (g/mol) 386.44
SMILES CCc1ccc(Cc2ccc3COC4(O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c3c2)cc1
Nombre IUPAC (3'R,4'S,5'S,6'R)-5-[(4-ethylphenyl)methyl]-6'-(hydroxymethyl)spiro[1H-2-benzofuran-3,2'-oxane]-3',4',5'-triol
3

3-(Methoxymethylene)-2(3H)-benzofuranone, TRC

CAS: 40800-90-6 Fórmula molecular: C10H8O3 Peso molecular (g/mol): 176.17 Nombre IUPAC: (3Z)-3-(methoxymethylidene)-1-benzofuran-2-one SMILES: CO\C=C\1/C(=O)Oc2ccccc12

Fórmula molecular C10H8O3
CAS 40800-90-6
Peso molecular (g/mol) 176.17
SMILES CO\C=C\1/C(=O)Oc2ccccc12
Nombre IUPAC (3Z)-3-(methoxymethylidene)-1-benzofuran-2-one
4

Phthalide, TRC

CAS: 87-41-2 Fórmula molecular: C8 H6 O2 Peso molecular (g/mol): 134.13 Sinónimo: 1(3H)-Isobenzofuranone (9CI, ACI),Phthalide (6CI, 8CI),1,3-Dihydro-2-benzofuran-1-one,1-Phthalanone,2-Benzofuran-1(3H)-one,2-Hydroxymethylbenzoic acid γ-lactone,3H-Isobenzofuran-1-one,NSC 1469,Phthalolactone Nombre IUPAC: 3H-2-benzofuran-1-one SMILES: O=C1OCc2ccccc12

Sinónimo 1(3H)-Isobenzofuranone (9CI, ACI),Phthalide (6CI, 8CI),1,3-Dihydro-2-benzofuran-1-one,1-Phthalanone,2-Benzofuran-1(3H)-one,2-Hydroxymethylbenzoic acid γ-lactone,3H-Isobenzofuran-1-one,NSC 1469,Phthalolactone
Fórmula molecular C8 H6 O2
CAS 87-41-2
Peso molecular (g/mol) 134.13
SMILES O=C1OCc2ccccc12
Nombre IUPAC 3H-2-benzofuran-1-one
5

7-Hydroxy-5-methoxy-4-methyl-6-[2-(tetrahydro-2-methyl-5-oxo-2-furanyl)ethyl]-1(3H)-isobenzofuranone, TRC

CAS: 26675-76-3 Fórmula molecular: C17 H20 O6 Peso molecular (g/mol): 320.34 Sinónimo: 1(3H)-Isobenzofuranone, 7-hydroxy-5-methoxy-4-methyl-6-[2-(tetrahydro-2-methyl-5-oxo-2-furanyl)ethyl]- (9CI),Phthalide, 7-hydroxy-5-methoxy-4-methyl-6-[2-(tetrahydro-2-methyl-5-oxo-2-furyl)ethyl]- (8CI),7-Hydroxy-5-methoxy-4-methyl-6-[2-[(2RS)-2-methyl-5-oxotetrahydrofuran-2-yl]ethyl]isobenzofuran-1(3H)-one,Mycophenolate Mofetil Imp. H (EP),Mycophenolate Sodium Imp. A (EP),Mycophenolic Acid Lactone Nombre IUPAC: 7-hydroxy-5-methoxy-4-methyl-6-[2-(2-methyl-5-oxooxolan-2-yl)ethyl]-3H-2-benzofuran-1-one SMILES: COc1c(C)c2COC(=O)c2c(O)c1CCC3(C)CCC(=O)O3

Sinónimo 1(3H)-Isobenzofuranone, 7-hydroxy-5-methoxy-4-methyl-6-[2-(tetrahydro-2-methyl-5-oxo-2-furanyl)ethyl]- (9CI),Phthalide, 7-hydroxy-5-methoxy-4-methyl-6-[2-(tetrahydro-2-methyl-5-oxo-2-furyl)ethyl]- (8CI),7-Hydroxy-5-methoxy-4-methyl-6-[2-[(2RS)-2-methyl-5-oxotetrahydrofuran-2-yl]ethyl]isobenzofuran-1(3H)-one,Mycophenolate Mofetil Imp. H (EP),Mycophenolate Sodium Imp. A (EP),Mycophenolic Acid Lactone
Fórmula molecular C17 H20 O6
CAS 26675-76-3
Peso molecular (g/mol) 320.34
SMILES COc1c(C)c2COC(=O)c2c(O)c1CCC3(C)CCC(=O)O3
Nombre IUPAC 7-hydroxy-5-methoxy-4-methyl-6-[2-(2-methyl-5-oxooxolan-2-yl)ethyl]-3H-2-benzofuran-1-one
6

Mycophenolate Mofetil N-Oxide (EP Impurity G), TRC

CAS: 224052-51-1 Fórmula molecular: C23 H31 N O8 Peso molecular (g/mol): 449.49 Sinónimo: 4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, 2-(4-oxido-4-morpholinyl)ethyl ester, (4E)- (9CI),2-(Morpholin-4-yl)ethyl (4E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoate N-Oxide,Mycophenolate Mofetil N-Oxide Nombre IUPAC: 2-(4-oxidomorpholin-4-ium-4-yl)ethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate SMILES: COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)OCC[N+]3([O-])CCOCC3

Sinónimo 4-Hexenoic acid, 6-(1,3-dihydro-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, 2-(4-oxido-4-morpholinyl)ethyl ester, (4E)- (9CI),2-(Morpholin-4-yl)ethyl (4E)-6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoate N-Oxide,Mycophenolate Mofetil N-Oxide
Fórmula molecular C23 H31 N O8
CAS 224052-51-1
Peso molecular (g/mol) 449.49
SMILES COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)\CCC(=O)OCC[N+]3([O-])CCOCC3
Nombre IUPAC 2-(4-oxidomorpholin-4-ium-4-yl)ethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
8

Meconin, TRC

CAS: 569-31-3 Fórmula molecular: C10 H10 O4 Peso molecular (g/mol): 194.18 Sinónimo: 1(3H)-Isobenzofuranone, 6,7-dimethoxy-,Phthalide, 6,7-dimethoxy- (6CI,7CI,8CI),6,7-Dimethoxy-1(3H)-isobenzofuranone,6,7-Dimethoxyphthalide,Meconic lactone,Meconin,Meconine,NSC 35547,Opianyl Nombre IUPAC: 6,7-dimethoxy-3H-2-benzofuran-1-one SMILES: COc1ccc2COC(=O)c2c1OC

Sinónimo 1(3H)-Isobenzofuranone, 6,7-dimethoxy-,Phthalide, 6,7-dimethoxy- (6CI,7CI,8CI),6,7-Dimethoxy-1(3H)-isobenzofuranone,6,7-Dimethoxyphthalide,Meconic lactone,Meconin,Meconine,NSC 35547,Opianyl
Fórmula molecular C10 H10 O4
CAS 569-31-3
Peso molecular (g/mol) 194.18
SMILES COc1ccc2COC(=O)c2c1OC
Nombre IUPAC 6,7-dimethoxy-3H-2-benzofuran-1-one
9

3-(4-Chlorobenzal)phthalide, TRC

CAS: 20526-97-0 Fórmula molecular: C15 H9 Cl O2 Peso molecular (g/mol): 256.68 Sinónimo: 1(3H)-Isobenzofuranone, 3-[(4-chlorophenyl)methylene]-,Phthalide, 3-(p-chlorobenzylidene)- (6CI,7CI,8CI),3-(4-Chlorobenzal)phthalide,3-(4-Chlorobenzylidene)-2-benzofuran-1(3H)-one,3-(p-Chlorobenzylidene)phthalide,Azelastine Related Compound E (USP) Nombre IUPAC: 3-[(4-chlorophenyl)methylidene]-2-benzofuran-1-one SMILES: Clc1ccc(C=C2OC(=O)c3ccccc23)cc1

Sinónimo 1(3H)-Isobenzofuranone, 3-[(4-chlorophenyl)methylene]-,Phthalide, 3-(p-chlorobenzylidene)- (6CI,7CI,8CI),3-(4-Chlorobenzal)phthalide,3-(4-Chlorobenzylidene)-2-benzofuran-1(3H)-one,3-(p-Chlorobenzylidene)phthalide,Azelastine Related Compound E (USP)
Fórmula molecular C15 H9 Cl O2
CAS 20526-97-0
Peso molecular (g/mol) 256.68
SMILES Clc1ccc(C=C2OC(=O)c3ccccc23)cc1
Nombre IUPAC 3-[(4-chlorophenyl)methylidene]-2-benzofuran-1-one
11

O-Methyl Mycophenolate Mofetil (EP Impurity D), TRC

CAS: 1322681-37-7 Fórmula molecular: C24 H33 N O7 Peso molecular (g/mol): 447.52 Sinónimo: 4-Hexenoic acid, 6-(1,3-dihydro-4,6-dimethoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, 2-(4-morpholinyl)ethyl ester, (4E)-,2-(Morpholin-4-yl)ethyl (4E)-6-(4,6-Dimethoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-4-methylhex-4-enoate,Mycophenolate Mofetil Imp. D (EP) Nombre IUPAC: 2-morpholin-4-ylethyl (E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate SMILES: COc1c(C)c2COC(=O)c2c(OC)c1C\C=C(/C)\CCC(=O)OCCN3CCOCC3

Sinónimo 4-Hexenoic acid, 6-(1,3-dihydro-4,6-dimethoxy-7-methyl-3-oxo-5-isobenzofuranyl)-4-methyl-, 2-(4-morpholinyl)ethyl ester, (4E)-,2-(Morpholin-4-yl)ethyl (4E)-6-(4,6-Dimethoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-4-methylhex-4-enoate,Mycophenolate Mofetil Imp. D (EP)
Fórmula molecular C24 H33 N O7
CAS 1322681-37-7
Peso molecular (g/mol) 447.52
SMILES COc1c(C)c2COC(=O)c2c(OC)c1C\C=C(/C)\CCC(=O)OCCN3CCOCC3
Nombre IUPAC 2-morpholin-4-ylethyl (E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate
13

Mycophenolic Acid Carboxybutoxy Ether, TRC

CAS: 931407-27-1 Fórmula molecular: C22H28O8 Peso molecular (g/mol): 420.45 Sinónimo: (4E)-6-[4-(4-Carboxybutoxy)-1,3-dihydro-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl]-4-methyl-4-hexenoic Acid,MPAC; Nombre IUPAC: (E)-6-(4-(4-carboxybutoxy)-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoic acid SMILES: CC1=C(C(=C(C2=C1COC2=O)OCCCCC(=O)O)C/C=C(\C)/CCC(=O)O)OC

Sinónimo (4E)-6-[4-(4-Carboxybutoxy)-1,3-dihydro-6-methoxy-7-methyl-3-oxo-5-isobenzofuranyl]-4-methyl-4-hexenoic Acid,MPAC;
Fórmula molecular C22H28O8
CAS 931407-27-1
Peso molecular (g/mol) 420.45
SMILES CC1=C(C(=C(C2=C1COC2=O)OCCCCC(=O)O)C/C=C(\C)/CCC(=O)O)OC
Nombre IUPAC (E)-6-(4-(4-carboxybutoxy)-6-methoxy-7-methyl-3-oxo-1,3-dihydroisobenzofuran-5-yl)-4-methylhex-4-enoic acid