methyl 2-(4-aminophenyl)-6-methoxy-7-(1-methyl-4-nitro-pyrrol-2-yl)carbonyloxy-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(4-aminophenyl)-6-methoxy-7-(1-methyl-4-nitro-pyrrol-2-yl)carbonyloxy-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-aminophenyl)-6-methoxy-7-(1-methyl-4-nitro-pyrrole-2-carbonyl)oxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-aminophenyl)-6-methoxy-7-[(1-methyl-4-nitro-2-pyrrolyl)-oxomethoxy]-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-aminophenyl)-6-methoxy-7-(1-methyl-4-nitropyrrole-2-carbonyl)oxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-aminophenyl)-1-keto-6-methoxy-7-(1-methyl-4-nitro-pyrrole-2-carbonyl)oxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C33H30N4O11 MolecularWeight: 658.6115

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC2=C(C=C3C(=C2)C(=O)N(C(=C3C4=CC(=C(C(=C4)OC)OC)OC)C(=O)OC)C5=CC=C(C=C5)N)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)OC2=C(C=C3C(=C2)C(=O)N(C(=C3C4=CC(=C(C(=C4)OC)OC)OC)C(=O)OC)C5=CC=C(C=C5)N)OC)[N+](=O)[O-]

InChI

InChI=1S/C33H30N4O11/c1-35-16-20(37(41)42)13-23(35)32(39)48-25-15-22-21(14-24(25)43-2)28(17-11-26(44-3)30(46-5)27(12-17)45-4)29(33(40)47-6)36(31(22)38)19-9-7-18(34)8-10-19/h7-16H,34H2,1-6H3