4-[[4-(2-oxidanylidene-3,4-dihydro-1H-quinolin-5-yl)piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2-oxidanylidene-3,4-dihydro-1H-quinolin-5-yl)piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2-oxo-3,4-dihydro-1H-quinolin-5-yl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2-keto-3,4-dihydro-1H-quinolin-5-yl)piperazino]methyl]benzonitrile Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=C1C(=CC=C2)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC(=O)NC2=C1C(=CC=C2)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H22N4O/c22-14-16-4-6-17(7-5-16)15-24-10-12-25(13-11-24)20-3-1-2-19-18(20)8-9-21(26)23-19/h1-7H,8-13,15H2,(H,23,26)