5-[2-(3,4-dimethoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide

Systemtic Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxamide Openeye Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxo-4-phenyl-isoquinoline-3-carboxamide CAS Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxo-4-phenyl-3-isoquinolinecarboxamide IUPAC Name: 5-[2-(3,4-dimethoxyphenyl)ethyl]-2,6,7-trimethyl-1-oxo-4-phenylisoquinoline-3-carboxamide Traditional Name: 5-homoveratryl-1-keto-2,6,7-trimethyl-4-phenyl-isoquinoline-3-carboxamide Formula: C29H30N2O4 MolecularWeight: 470.5595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C(=O)N(C(=C2C3=CC=CC=C3)C(=O)N)C)CCC4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CC1=C(C(=C2C(=C1)C(=O)N(C(=C2C3=CC=CC=C3)C(=O)N)C)CCC4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C29H30N2O4/c1-17-15-22-26(21(18(17)2)13-11-19-12-14-23(34-4)24(16-19)35-5)25(20-9-7-6-8-10-20)27(28(30)32)31(3)29(22)33/h6-10,12,14-16H,11,13H2,1-5H3,(H2,30,32)