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

Systemtic Name: (4-chlorophenyl)-[4-(diphenylmethyl)piperazin-4-ium-1-yl]methanone chloride Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-chlorophenyl)methanone chloride CAS Name: (4-chlorophenyl)-[4-(diphenylmethyl)-1-piperazin-4-iumyl]methanone chloride IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-chlorophenyl)methanone chloride Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-(4-chlorophenyl)methanone chloride Formula: C24H24Cl2N2O MolecularWeight: 427.36616

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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=C(C=C4)Cl.[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C24H23ClN2O.ClH/c25-22-13-11-21(12-14-22)24(28)27-17-15-26(16-18-27)23(19-7-3-1-4-8-19)20-9-5-2-6-10-20;/h1-14,23H,15-18H2;1H