methyl 1-oxidanylidene-2-phenyl-7-(quinolin-2-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride

Systemtic Name: methyl 1-oxidanylidene-2-phenyl-7-(quinolin-2-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Openeye Name: methyl 1-oxo-2-phenyl-7-(2-quinolylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride CAS Name: 1-oxo-2-phenyl-7-(2-quinolinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 1-oxo-2-phenyl-7-(quinolin-2-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Traditional Name: 1-keto-2-phenyl-7-(2-quinolylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester hydrochloride Formula: C36H31ClN2O7 MolecularWeight: 639.09354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=C2C=CC(=C3)OCC4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6)C(=O)OC.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=C2C=CC(=C3)OCC4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6)C(=O)OC.Cl

InChI

InChI=1S/C36H30N2O7.ClH/c1-41-30-18-23(19-31(42-2)34(30)43-3)32-27-17-16-26(45-21-24-15-14-22-10-8-9-13-29(22)37-24)20-28(27)35(39)38(33(32)36(40)44-4)25-11-6-5-7-12-25;/h5-20H,21H2,1-4H3;1H