(4-cyclohexylphenyl)-diphenyl-sulfanium; 4-(trifluoromethyl)benzenesulfonate

Systemtic Name: (4-cyclohexylphenyl)-diphenyl-sulfanium; 4-(trifluoromethyl)benzenesulfonate Openeye Name: (4-cyclohexylphenyl)-diphenyl-sulfonium; 4-(trifluoromethyl)benzenesulfonate CAS Name: (4-cyclohexylphenyl)-diphenylsulfonium; 4-(trifluoromethyl)benzenesulfonate IUPAC Name: (4-cyclohexylphenyl)-diphenylsulfanium; 4-(trifluoromethyl)benzenesulfonate Traditional Name: (4-cyclohexylphenyl)-diphenyl-sulfonium; 4-(trifluoromethyl)besylate Formula: C31H29F3O3S2 MolecularWeight: 570.68537

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4.C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4.C1=CC(=CC=C1C(F)(F)F)S(=O)(=O)[O-]

InChI

InChI=1S/C24H25S.C7H5F3O3S/c1-4-10-20(11-5-1)21-16-18-24(19-17-21)25(22-12-6-2-7-13-22)23-14-8-3-9-15-23;8-7(9,10)5-1-3-6(4-2-5)14(11,12)13/h2-3,6-9,12-20H,1,4-5,10-11H2;1-4H,(H,11,12,13)/q+1;/p-1