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

Systemtic Name: methyl 1-oxidanylidene-2-phenyl-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 1-oxo-2-phenyl-7-(4-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 1-oxo-2-phenyl-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-oxo-2-phenyl-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 1-keto-2-phenyl-7-(4-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C32H28N2O7 MolecularWeight: 552.57392

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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=CC=NC=C4)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=C2C=CC(=C3)OCC4=CC=NC=C4)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C32H28N2O7/c1-37-26-16-21(17-27(38-2)30(26)39-3)28-24-11-10-23(41-19-20-12-14-33-15-13-20)18-25(24)31(35)34(29(28)32(36)40-4)22-8-6-5-7-9-22/h5-18H,19H2,1-4H3