2-chloranyl-4-[4-(quinolin-2-ylmethyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[4-(quinolin-2-ylmethyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-chloro-4-[4-(2-quinolylmethyl)piperazin-1-yl]benzonitrile CAS Name: 2-chloro-4-[4-(2-quinolinylmethyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-chloro-4-[4-(quinolin-2-ylmethyl)piperazin-1-yl]benzonitrile Traditional Name: 2-chloro-4-[4-(2-quinolylmethyl)piperazino]benzonitrile Formula: C21H19ClN4 MolecularWeight: 362.85536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C=C2)C4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C=C2)C4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C21H19ClN4/c22-20-13-19(8-6-17(20)14-23)26-11-9-25(10-12-26)15-18-7-5-16-3-1-2-4-21(16)24-18/h1-8,13H,9-12,15H2