(2-tert-butylphenyl)-diphenyl-sulfanium; 2,3,4-tris(fluoranyl)benzenesulfonate

Systemtic Name: (2-tert-butylphenyl)-diphenyl-sulfanium; 2,3,4-tris(fluoranyl)benzenesulfonate Openeye Name: (2-tert-butylphenyl)-diphenyl-sulfonium; 2,3,4-trifluorobenzenesulfonate CAS Name: (2-tert-butylphenyl)-diphenylsulfonium; 2,3,4-trifluorobenzenesulfonate IUPAC Name: (2-tert-butylphenyl)-diphenylsulfanium; 2,3,4-trifluorobenzenesulfonate Traditional Name: (2-tert-butylphenyl)-diphenyl-sulfonium; 2,3,4-trifluorobesylate Formula: C28H25F3O3S2 MolecularWeight: 530.62151

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC(=C(C(=C1F)F)F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC(=C(C(=C1F)F)F)S(=O)(=O)[O-]

InChI

InChI=1S/C22H23S.C6H3F3O3S/c1-22(2,3)20-16-10-11-17-21(20)23(18-12-6-4-7-13-18)19-14-8-5-9-15-19;7-3-1-2-4(13(10,11)12)6(9)5(3)8/h4-17H,1-3H3;1-2H,(H,10,11,12)/q+1;/p-1