2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-methyl-ethanamide

Systemtic Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: 2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-N-(2-cyanoethyl)-N-methylacetamide IUPAC Name: 2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[4-(3-chlorobenzyl)piperazino]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C17H23ClN4O MolecularWeight: 334.84372

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CN1CCN(CC1)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CN(CCC#N)C(=O)CN1CCN(CC1)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H23ClN4O/c1-20(7-3-6-19)17(23)14-22-10-8-21(9-11-22)13-15-4-2-5-16(18)12-15/h2,4-5,12H,3,7-11,13-14H2,1H3