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

Systemtic Name: 3-chloranyl-4-[[4-(phenylmethyl)piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[(4-benzylpiperazin-1-yl)methyl]-3-chloro-benzonitrile CAS Name: 3-chloro-4-[[4-(phenylmethyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[(4-benzylpiperazin-1-yl)methyl]-3-chlorobenzonitrile Traditional Name: 4-[(4-benzylpiperazino)methyl]-3-chloro-benzonitrile Formula: C19H20ClN3 MolecularWeight: 325.8352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3/c20-19-12-17(13-21)6-7-18(19)15-23-10-8-22(9-11-23)14-16-4-2-1-3-5-16/h1-7,12H,8-11,14-15H2