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

Systemtic Name: methyl 6-methoxy-2-morpholin-4-yl-1-oxidanylidene-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 6-methoxy-2-morpholino-1-oxo-7-(4-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 6-methoxy-2-(4-morpholinyl)-1-oxo-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 6-methoxy-2-morpholin-4-yl-1-oxo-7-(pyridin-4-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 1-keto-6-methoxy-2-morpholino-7-(4-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C31H33N3O9 MolecularWeight: 591.60842

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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)OCC4=CC=NC=C4)N5CCOCC5)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=CC(=C(C=C32)OC)OCC4=CC=NC=C4)N5CCOCC5)C(=O)OC

InChI

InChI=1S/C31H33N3O9/c1-37-23-16-21-22(17-24(23)43-18-19-6-8-32-9-7-19)30(35)34(33-10-12-42-13-11-33)28(31(36)41-5)27(21)20-14-25(38-2)29(40-4)26(15-20)39-3/h6-9,14-17H,10-13,18H2,1-5H3