N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-keto-2-(4-methoxyphenyl)isoquinoline-4-carboxamide Formula: C29H30N2O5 MolecularWeight: 486.5589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CN(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)OC)OCC

InChI

InChI=1S/C29H30N2O5/c1-4-35-26-15-10-20(18-27(26)36-5-2)16-17-30-28(32)25-19-31(21-11-13-22(34-3)14-12-21)29(33)24-9-7-6-8-23(24)25/h6-15,18-19H,4-5,16-17H2,1-3H3,(H,30,32)