4-[4-(3-methylphenyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(3-methylphenyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-(m-tolyl)piperazin-1-yl]benzonitrile CAS Name: 4-[4-(3-methylphenyl)-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-(3-methylphenyl)piperazin-1-yl]benzonitrile Traditional Name: 4-[4-(m-tolyl)piperazino]benzonitrile Formula: C18H19N3 MolecularWeight: 277.36356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H19N3/c1-15-3-2-4-18(13-15)21-11-9-20(10-12-21)17-7-5-16(14-19)6-8-17/h2-8,13H,9-12H2,1H3