methyl 2-(4-aminophenyl)-1-oxidanylidene-8-(quinolin-2-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate

Systemtic Name: methyl 2-(4-aminophenyl)-1-oxidanylidene-8-(quinolin-2-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-(4-aminophenyl)-1-oxo-8-(2-quinolylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-aminophenyl)-1-oxo-8-(2-quinolinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-aminophenyl)-1-oxo-8-(quinolin-2-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 2-(4-aminophenyl)-1-keto-8-(2-quinolylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C36H31N3O7 MolecularWeight: 617.64724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=C2C=CC=C3OCC4=NC5=CC=CC=C5C=C4)C6=CC=C(C=C6)N)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=C2C=CC=C3OCC4=NC5=CC=CC=C5C=C4)C6=CC=C(C=C6)N)C(=O)OC

InChI

InChI=1S/C36H31N3O7/c1-42-29-18-22(19-30(43-2)34(29)44-3)31-26-9-7-11-28(46-20-24-15-12-21-8-5-6-10-27(21)38-24)32(26)35(40)39(33(31)36(41)45-4)25-16-13-23(37)14-17-25/h5-19H,20,37H2,1-4H3