4-[[4-(4-cyanophenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(4-cyanophenyl)carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(4-cyanobenzoyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(4-cyanophenyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(4-cyanobenzoyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(4-cyanobenzoyl)piperazino]methyl]benzonitrile Formula: C20H18N4O MolecularWeight: 330.38312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O/c21-13-16-1-3-18(4-2-16)15-23-9-11-24(12-10-23)20(25)19-7-5-17(14-22)6-8-19/h1-8H,9-12,15H2