1-(3-chlorophenyl)piperazin-4-ium-2-one chloride

Systemtic Name: 1-(3-chlorophenyl)piperazin-4-ium-2-one chloride Openeye Name: 1-(3-chlorophenyl)piperazin-4-ium-2-one chloride CAS Name: 1-(3-chlorophenyl)-2-piperazin-4-iumone chloride IUPAC Name: 1-(3-chlorophenyl)piperazin-4-ium-2-one chloride Traditional Name: 1-(3-chlorophenyl)piperazin-4-ium-2-one chloride Formula: C10H12Cl2N2O MolecularWeight: 247.12108

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C[NH2+]1)C2=CC(=CC=C2)Cl.[Cl-]

Isomeric SMILES

C1CN(C(=O)C[NH2+]1)C2=CC(=CC=C2)Cl.[Cl-]

InChI

InChI=1S/C10H11ClN2O.ClH/c11-8-2-1-3-9(6-8)13-5-4-12-7-10(13)14;/h1-3,6,12H,4-5,7H2;1H