3-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 3-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[[4-[(4-cyanophenyl)methyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-(4-cyanobenzyl)piperazino]methyl]benzonitrile Formula: C20H20N4 MolecularWeight: 316.3996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H20N4/c21-13-17-4-6-18(7-5-17)15-23-8-10-24(11-9-23)16-20-3-1-2-19(12-20)14-22/h1-7,12H,8-11,15-16H2