2-chloranyl-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]ethanone chloride

Systemtic Name: 2-chloranyl-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]ethanone chloride Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-chloro-ethanone chloride CAS Name: 2-chloro-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]ethanone chloride IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-chloroethanone chloride Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-chloro-ethanone chloride Formula: C19H22Cl2N2O MolecularWeight: 365.29678

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCl.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCl.[Cl-]

InChI

InChI=1S/C19H21ClN2O.ClH/c20-15-18(23)21-11-13-22(14-12-21)19(16-7-3-1-4-8-16)17-9-5-2-6-10-17;/h1-10,19H,11-15H2;1H