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

Systemtic Name: methyl 2-morpholin-4-yl-1-oxidanylidene-7-(pyridin-3-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Openeye Name: methyl 2-morpholino-1-oxo-7-(3-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate CAS Name: 2-(4-morpholinyl)-1-oxo-7-(3-pyridinylmethoxy)-4-(3,4,5-trimethoxyphenyl)-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-morpholin-4-yl-1-oxo-7-(pyridin-3-ylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylate Traditional Name: 1-keto-2-morpholino-7-(3-pyridylmethoxy)-4-(3,4,5-trimethoxyphenyl)isoquinoline-3-carboxylic acid methyl ester Formula: C30H31N3O8 MolecularWeight: 561.58244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=C2C=CC(=C3)OCC4=CN=CC=C4)N5CCOCC5)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(N(C(=O)C3=C2C=CC(=C3)OCC4=CN=CC=C4)N5CCOCC5)C(=O)OC

InChI

InChI=1S/C30H31N3O8/c1-36-24-14-20(15-25(37-2)28(24)38-3)26-22-8-7-21(41-18-19-6-5-9-31-17-19)16-23(22)29(34)33(27(26)30(35)39-4)32-10-12-40-13-11-32/h5-9,14-17H,10-13,18H2,1-4H3