methyl 6-methoxy-1-oxidanylidene-2-phenyl-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride

Systemtic Name: methyl 6-methoxy-1-oxidanylidene-2-phenyl-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Openeye Name: methyl 6-methoxy-1-oxo-2-phenyl-7-(4-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride CAS Name: 6-methoxy-1-oxo-2-phenyl-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 6-methoxy-1-oxo-2-phenyl-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate hydrochloride Traditional Name: 1-keto-6-methoxy-2-phenyl-7-(4-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester hydrochloride Formula: C33H31ClN2O8 MolecularWeight: 619.06084

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)OCC4=CC=NC=C4)C5=CC=CC=C5)C(=O)OC.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OCC4=CC=NC=C4)C5=CC=CC=C5)C(=O)OC.Cl

InChI

InChI=1S/C33H30N2O8.ClH/c1-38-25-17-23-24(18-26(25)43-19-20-11-13-34-14-12-20)32(36)35(22-9-7-6-8-10-22)30(33(37)42-5)29(23)21-15-27(39-2)31(41-4)28(16-21)40-3;/h6-18H,19H2,1-5H3;1H