1-[2-(4-chlorophenyl)sulfonylethyl]-4-(diphenylmethyl)piperidin-1-ium

Systemtic Name: 1-[2-(4-chlorophenyl)sulfonylethyl]-4-(diphenylmethyl)piperidin-1-ium Openeye Name: 4-benzhydryl-1-[2-(4-chlorophenyl)sulfonylethyl]piperidin-1-ium CAS Name: 1-[2-(4-chlorophenyl)sulfonylethyl]-4-(diphenylmethyl)piperidin-1-ium IUPAC Name: 4-benzhydryl-1-[2-(4-chlorophenyl)sulfonylethyl]piperidin-1-ium Traditional Name: 4-benzhydryl-1-[2-(4-chlorophenyl)sulfonylethyl]piperidin-1-ium Formula: C26H29ClNO2S+ MolecularWeight: 455.03196

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(C2=CC=CC=C2)C3=CC=CC=C3)CCS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1C(C2=CC=CC=C2)C3=CC=CC=C3)CCS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H28ClNO2S/c27-24-11-13-25(14-12-24)31(29,30)20-19-28-17-15-23(16-18-28)26(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,23,26H,15-20H2/p+1