3-[3-(4-methylpiperazin-1-yl)propyl]-2H-isoquinolin-1-one

Systemtic Name: 3-[3-(4-methylpiperazin-1-yl)propyl]-2H-isoquinolin-1-one Openeye Name: 3-[3-(4-methylpiperazin-1-yl)propyl]-2H-isoquinolin-1-one CAS Name: 3-[3-(4-methyl-1-piperazinyl)propyl]-2H-isoquinolin-1-one IUPAC Name: 3-[3-(4-methylpiperazin-1-yl)propyl]-2H-isoquinolin-1-one Traditional Name: 3-[3-(4-methylpiperazino)propyl]isocarbostyril Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCC2=CC3=CC=CC=C3C(=O)N2

Isomeric SMILES

CN1CCN(CC1)CCCC2=CC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C17H23N3O/c1-19-9-11-20(12-10-19)8-4-6-15-13-14-5-2-3-7-16(14)17(21)18-15/h2-3,5,7,13H,4,6,8-12H2,1H3,(H,18,21)