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

Systemtic Name: 4-[4-(2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)piperazine-1-carbonyl]benzonitrile CAS Name: 4-[oxo-[4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)piperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-(2-keto-3,4-dihydro-1H-quinolin-6-yl)piperazine-1-carbonyl]benzonitrile Formula: C21H20N4O2 MolecularWeight: 360.4091

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4O2/c22-14-15-1-3-16(4-2-15)21(27)25-11-9-24(10-12-25)18-6-7-19-17(13-18)5-8-20(26)23-19/h1-4,6-7,13H,5,8-12H2,(H,23,26)