6-[(E)-4-[4-(3-methylphenyl)piperazin-1-yl]but-1-enyl]-1H-quinolin-2-one hydrochloride

Systemtic Name: 6-[(E)-4-[4-(3-methylphenyl)piperazin-1-yl]but-1-enyl]-1H-quinolin-2-one hydrochloride Openeye Name: 6-[(E)-4-[4-(m-tolyl)piperazin-1-yl]but-1-enyl]-1H-quinolin-2-one hydrochloride CAS Name: 6-[(E)-4-[4-(3-methylphenyl)-1-piperazinyl]but-1-enyl]-1H-quinolin-2-one hydrochloride IUPAC Name: 6-[(E)-4-[4-(3-methylphenyl)piperazin-1-yl]but-1-enyl]-1H-quinolin-2-one hydrochloride Traditional Name: 6-[(E)-4-[4-(m-tolyl)piperazino]but-1-enyl]carbostyril hydrochloride Formula: C24H28ClN3O MolecularWeight: 409.95162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCC=CC3=CC4=C(C=C3)NC(=O)C=C4.Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CC/C=C/C3=CC4=C(C=C3)NC(=O)C=C4.Cl

InChI

InChI=1S/C24H27N3O.ClH/c1-19-5-4-7-22(17-19)27-15-13-26(14-16-27)12-3-2-6-20-8-10-23-21(18-20)9-11-24(28)25-23;/h2,4-11,17-18H,3,12-16H2,1H3,(H,25,28);1H/b6-2+;