2-(4-ethanoylpiperazin-1-ium-1-yl)-1-phenyl-ethanone chloride

Systemtic Name: 2-(4-ethanoylpiperazin-1-ium-1-yl)-1-phenyl-ethanone chloride Openeye Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-phenyl-ethanone chloride CAS Name: 2-(4-acetyl-1-piperazin-1-iumyl)-1-phenylethanone chloride IUPAC Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-phenylethanone chloride Traditional Name: 2-(4-acetylpiperazin-1-ium-1-yl)-1-phenyl-ethanone chloride Formula: C14H19ClN2O2 MolecularWeight: 282.76586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C14H18N2O2.ClH/c1-12(17)16-9-7-15(8-10-16)11-14(18)13-5-3-2-4-6-13;/h2-6H,7-11H2,1H3;1H