N-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxoisoquinoline-4-carboxamide Traditional Name: 1-keto-6,7-dimethoxy-2-methyl-N-p-phenetyl-isoquinoline-4-carboxamide Formula: C21H22N2O5 MolecularWeight: 382.40978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)C

InChI

InChI=1S/C21H22N2O5/c1-5-28-14-8-6-13(7-9-14)22-20(24)17-12-23(2)21(25)16-11-19(27-4)18(26-3)10-15(16)17/h6-12H,5H2,1-4H3,(H,22,24)