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

Systemtic Name: methyl 2-(4-aminophenyl)-6-methoxy-1-oxidanylidene-7-phenacyloxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-aminophenyl)-6-methoxy-1-oxo-7-phenacyloxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-aminophenyl)-6-methoxy-1-oxo-7-phenacyloxy-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-aminophenyl)-6-methoxy-1-oxo-7-phenacyloxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-aminophenyl)-1-keto-6-methoxy-7-phenacyloxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C35H32N2O9 MolecularWeight: 624.63658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C35H32N2O9/c1-41-27-17-24-25(18-28(27)46-19-26(38)20-9-7-6-8-10-20)34(39)37(23-13-11-22(36)12-14-23)32(35(40)45-5)31(24)21-15-29(42-2)33(44-4)30(16-21)43-3/h6-18H,19,36H2,1-5H3