methyl 2-(4-aminophenyl)-6-methoxy-1-oxidanylidene-7-(1H-pyrrol-2-ylcarbonyloxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(4-aminophenyl)-6-methoxy-1-oxidanylidene-7-(1H-pyrrol-2-ylcarbonyloxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-aminophenyl)-6-methoxy-1-oxo-7-(1H-pyrrole-2-carbonyloxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-aminophenyl)-6-methoxy-1-oxo-7-[oxo(1H-pyrrol-2-yl)methoxy]-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-aminophenyl)-6-methoxy-1-oxo-7-(1H-pyrrole-2-carbonyloxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-aminophenyl)-1-keto-6-methoxy-7-(1H-pyrrole-2-carbonyloxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C32H29N3O9 MolecularWeight: 599.58736

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC(=O)C4=CC=CN4)C5=CC=C(C=C5)N)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OC(=O)C4=CC=CN4)C5=CC=C(C=C5)N)C(=O)OC

InChI

InChI=1S/C32H29N3O9/c1-39-23-15-20-21(16-24(23)44-31(37)22-7-6-12-34-22)30(36)35(19-10-8-18(33)9-11-19)28(32(38)43-5)27(20)17-13-25(40-2)29(42-4)26(14-17)41-3/h6-16,34H,33H2,1-5H3