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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClN4O/c1-17(2,13-19)20(3)16(23)12-21-7-9-22(10-8-21)15-6-4-5-14(18)11-15/h4-6,11H,7-10,12H2,1-3H3