2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(4-chlorobenzoyl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(4-chlorobenzoyl)piperazino]acetonitrile Formula: C13H14ClN3O MolecularWeight: 263.72276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1CN(CCN1CC#N)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H14ClN3O/c14-12-3-1-11(2-4-12)13(18)17-9-7-16(6-5-15)8-10-17/h1-4H,6-10H2