3-[4-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)carbonyl]piperazin-1-yl]propanenitrile hydrochloride

Systemtic Name: 3-[4-[(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)carbonyl]piperazin-1-yl]propanenitrile hydrochloride Openeye Name: 3-[4-(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)piperazin-1-yl]propanenitrile hydrochloride CAS Name: 3-[4-[oxo-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]-1-piperazinyl]propanenitrile hydrochloride IUPAC Name: 3-[4-(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)piperazin-1-yl]propanenitrile hydrochloride Traditional Name: 3-[4-(2-keto-3,4-dihydro-1H-quinoline-6-carbonyl)piperazino]propionitrile hydrochloride Formula: C17H21ClN4O2 MolecularWeight: 348.82724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)CCC#N.Cl

Isomeric SMILES

C1CC(=O)NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)CCC#N.Cl

InChI

InChI=1S/C17H20N4O2.ClH/c18-6-1-7-20-8-10-21(11-9-20)17(23)14-2-4-15-13(12-14)3-5-16(22)19-15;/h2,4,12H,1,3,5,7-11H2,(H,19,22);1H