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

Systemtic Name: 2-[4-(quinolin-2-ylmethyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-(2-quinolylmethyl)piperazin-1-yl]benzonitrile CAS Name: 2-[4-(2-quinolinylmethyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(quinolin-2-ylmethyl)piperazin-1-yl]benzonitrile Traditional Name: 2-[4-(2-quinolylmethyl)piperazino]benzonitrile Formula: C21H20N4 MolecularWeight: 328.4103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C=C2)C4=CC=CC=C4C#N

InChI

InChI=1S/C21H20N4/c22-15-18-6-2-4-8-21(18)25-13-11-24(12-14-25)16-19-10-9-17-5-1-3-7-20(17)23-19/h1-10H,11-14,16H2