1-(4-chlorophenyl)sulfonyl-4-(diphenylmethyl)piperazin-4-ium chloride

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-(diphenylmethyl)piperazin-4-ium chloride Openeye Name: 1-benzhydryl-4-(4-chlorophenyl)sulfonyl-piperazin-1-ium chloride CAS Name: 1-(4-chlorophenyl)sulfonyl-4-(diphenylmethyl)piperazin-4-ium chloride IUPAC Name: 1-benzhydryl-4-(4-chlorophenyl)sulfonylpiperazin-1-ium chloride Traditional Name: 1-benzhydryl-4-(4-chlorophenyl)sulfonyl-piperazin-1-ium chloride Formula: C23H24Cl2N2O2S MolecularWeight: 463.41986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN2O2S.ClH/c24-21-11-13-22(14-12-21)29(27,28)26-17-15-25(16-18-26)23(19-7-3-1-4-8-19)20-9-5-2-6-10-20;/h1-14,23H,15-18H2;1H