(2-tert-butylphenyl)-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (2-tert-butylphenyl)-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: (2-tert-butylphenyl)-diphenyl-sulfonium; trifluoromethanesulfonate CAS Name: (2-tert-butylphenyl)-diphenylsulfonium; trifluoromethanesulfonate IUPAC Name: (2-tert-butylphenyl)-diphenylsulfanium; trifluoromethanesulfonate Traditional Name: (2-tert-butylphenyl)-diphenyl-sulfonium triflate Formula: C23H23F3O3S2 MolecularWeight: 468.55213

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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.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H23S.CHF3O3S/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;2-1(3,4)8(5,6)7/h4-17H,1-3H3;(H,5,6,7)/q+1;/p-1