1-(diphenylmethyl)-4-(phenylsulfonyl)piperazin-1-ium chloride

Systemtic Name: 1-(diphenylmethyl)-4-(phenylsulfonyl)piperazin-1-ium chloride Openeye Name: 1-(benzenesulfonyl)-4-benzhydryl-piperazin-4-ium chloride CAS Name: 1-(benzenesulfonyl)-4-(diphenylmethyl)piperazin-4-ium chloride IUPAC Name: 1-(benzenesulfonyl)-4-benzhydrylpiperazin-4-ium chloride Traditional Name: 1-benzhydryl-4-besyl-piperazin-1-ium chloride Formula: C23H25ClN2O2S MolecularWeight: 428.9748

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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=CC=C4.[Cl-]

Isomeric SMILES

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

InChI

InChI=1S/C23H24N2O2S.ClH/c26-28(27,22-14-8-3-9-15-22)25-18-16-24(17-19-25)23(20-10-4-1-5-11-20)21-12-6-2-7-13-21;/h1-15,23H,16-19H2;1H