methyl 2-(4-acetamidophenyl)-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(4-acetamidophenyl)-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-acetamidophenyl)-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-acetamidophenyl)-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-acetamidophenyl)-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-acetamidophenyl)-1-keto-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C28H26N2O7 MolecularWeight: 502.51524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2C(=C(C3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2C(=C(C3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)OC

InChI

InChI=1S/C28H26N2O7/c1-16(31)29-18-10-12-19(13-11-18)30-25(28(33)37-5)24(20-8-6-7-9-21(20)27(30)32)17-14-22(34-2)26(36-4)23(15-17)35-3/h6-15H,1-5H3,(H,29,31)