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

Systemtic Name: 2-(3,4-dimethylphenyl)-N-(2-morpholin-4-ylethyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-(2-morpholinoethyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[2-(4-morpholinyl)ethyl]-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-(2-morpholin-4-ylethyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-1-keto-N-(2-morpholinoethyl)isoquinoline-4-carboxamide Formula: C24H27N3O3 MolecularWeight: 405.48948

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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)NCCN4CCOCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)NCCN4CCOCC4)C

InChI

InChI=1S/C24H27N3O3/c1-17-7-8-19(15-18(17)2)27-16-22(20-5-3-4-6-21(20)24(27)29)23(28)25-9-10-26-11-13-30-14-12-26/h3-8,15-16H,9-14H2,1-2H3,(H,25,28)