N-[3-[ethyl-(3-methylphenyl)amino]propyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide

Systemtic Name: N-[3-[ethyl-(3-methylphenyl)amino]propyl]-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide Openeye Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-(1-oxo-2-isoquinolyl)acetamide CAS Name: N-[3-(N-ethyl-3-methylanilino)propyl]-2-(1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-[3-(N-ethyl-3-methylanilino)propyl]-2-(1-oxoisoquinolin-2-yl)acetamide Traditional Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-(1-keto-2-isoquinolyl)acetamide Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)CN1C=CC2=CC=CC=C2C1=O)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCCNC(=O)CN1C=CC2=CC=CC=C2C1=O)C3=CC=CC(=C3)C

InChI

InChI=1S/C23H27N3O2/c1-3-25(20-10-6-8-18(2)16-20)14-7-13-24-22(27)17-26-15-12-19-9-4-5-11-21(19)23(26)28/h4-6,8-12,15-16H,3,7,13-14,17H2,1-2H3,(H,24,27)