[4-(diphenylmethyl)piperazin-4-ium-1-yl]-phenyl-methanone chloride

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-phenyl-methanone chloride Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-phenyl-methanone chloride CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-phenylmethanone chloride IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-phenylmethanone chloride Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-phenyl-methanone chloride Formula: C24H25ClN2O MolecularWeight: 392.9211

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C24H24N2O.ClH/c27-24(22-14-8-3-9-15-22)26-18-16-25(17-19-26)23(20-10-4-1-5-11-20)21-12-6-2-7-13-21;/h1-15,23H,16-19H2;1H