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

Systemtic Name: methyl 2-(4-aminophenyl)-7-(cyclopropylmethoxy)-6-methoxy-1-oxidanylidene-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-aminophenyl)-7-(cyclopropylmethoxy)-6-methoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-aminophenyl)-7-(cyclopropylmethoxy)-6-methoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-aminophenyl)-7-(cyclopropylmethoxy)-6-methoxy-1-oxo-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-aminophenyl)-7-(cyclopropylmethoxy)-1-keto-6-methoxy-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C31H32N2O8 MolecularWeight: 560.59438

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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)OCC4CC4)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)OCC4CC4)C5=CC=C(C=C5)N)C(=O)OC

InChI

InChI=1S/C31H32N2O8/c1-36-23-14-21-22(15-24(23)41-16-17-6-7-17)30(34)33(20-10-8-19(32)9-11-20)28(31(35)40-5)27(21)18-12-25(37-2)29(39-4)26(13-18)38-3/h8-15,17H,6-7,16,32H2,1-5H3