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

Systemtic Name: 3-azanylidene-3-[4-(2-chlorophenyl)piperazin-1-yl]propanenitrile Openeye Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]-3-imino-propanenitrile CAS Name: 3-[4-(2-chlorophenyl)-1-piperazinyl]-3-iminopropanenitrile IUPAC Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]-3-iminopropanenitrile Traditional Name: 3-[4-(2-chlorophenyl)piperazino]-3-imino-propionitrile Formula: C13H15ClN4 MolecularWeight: 262.738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN4/c14-11-3-1-2-4-12(11)17-7-9-18(10-8-17)13(16)5-6-15/h1-4,16H,5,7-10H2