N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide

Systemtic Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: N-cyclopropyl-N-(2,5-dimethoxybenzyl)-1-keto-2H-isoquinoline-3-carboxamide Formula: C22H22N2O4 MolecularWeight: 378.42108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(C2CC2)C(=O)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(C2CC2)C(=O)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C22H22N2O4/c1-27-17-9-10-20(28-2)15(11-17)13-24(16-7-8-16)22(26)19-12-14-5-3-4-6-18(14)21(25)23-19/h3-6,9-12,16H,7-8,13H2,1-2H3,(H,23,25)