2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)ethanamide

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)ethanamide Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide CAS Name: 2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-N-[(cyclopropylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide Traditional Name: 2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide Formula: C16H22ClN4O2+ MolecularWeight: 337.82448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1CC1NC(=O)NC(=O)C[NH+]2CCN(CC2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H21ClN4O2/c17-12-2-1-3-14(10-12)21-8-6-20(7-9-21)11-15(22)19-16(23)18-13-4-5-13/h1-3,10,13H,4-9,11H2,(H2,18,19,22,23)/p+1