N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-piperazin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-chloranyl-2-(phenylcarbonyl)phenyl]-2-piperazin-1-ium-1-yl-ethanamide Openeye Name: N-(2-benzoyl-4-chloro-phenyl)-2-piperazin-1-ium-1-yl-acetamide CAS Name: N-(2-benzoyl-4-chlorophenyl)-2-(1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2-benzoyl-4-chlorophenyl)-2-piperazin-1-ium-1-ylacetamide Traditional Name: N-(2-benzoyl-4-chloro-phenyl)-2-piperazin-1-ium-1-yl-acetamide Formula: C19H21ClN3O2+ MolecularWeight: 358.84194

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCN1)CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCN1)CC(=O)NC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H20ClN3O2/c20-15-6-7-17(22-18(24)13-23-10-8-21-9-11-23)16(12-15)19(25)14-4-2-1-3-5-14/h1-7,12,21H,8-11,13H2,(H,22,24)/p+1