3-[4-(2-chlorophenyl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(2-chlorophenyl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-(2-chlorophenyl)-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(2-chlorophenyl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(2-chlorophenyl)piperazine-1-carbonyl]benzonitrile Formula: C18H16ClN3O MolecularWeight: 325.79214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H16ClN3O/c19-16-6-1-2-7-17(16)21-8-10-22(11-9-21)18(23)15-5-3-4-14(12-15)13-20/h1-7,12H,8-11H2