2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-(3-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-1-keto-N-(3-methoxyphenyl)isoquinoline-4-carboxamide Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC(=CC=C4)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NC4=CC(=CC=C4)OC)C

InChI

InChI=1S/C25H22N2O3/c1-16-11-12-19(13-17(16)2)27-15-23(21-9-4-5-10-22(21)25(27)29)24(28)26-18-7-6-8-20(14-18)30-3/h4-15H,1-3H3,(H,26,28)