phenyl-bis[4-(trifluoromethyl)phenyl]sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: phenyl-bis[4-(trifluoromethyl)phenyl]sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: phenyl-bis[4-(trifluoromethyl)phenyl]sulfonium; trifluoromethanesulfonate CAS Name: phenyl-bis[4-(trifluoromethyl)phenyl]sulfonium; trifluoromethanesulfonate IUPAC Name: phenyl-bis[4-(trifluoromethyl)phenyl]sulfanium; trifluoromethanesulfonate Traditional Name: phenyl-bis[4-(trifluoromethyl)phenyl]sulfonium triflate Formula: C21H13F9O3S2 MolecularWeight: 548.441749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13F6S.CHF3O3S/c21-19(22,23)14-6-10-17(11-7-14)27(16-4-2-1-3-5-16)18-12-8-15(9-13-18)20(24,25)26;2-1(3,4)8(5,6)7/h1-13H;(H,5,6,7)/q+1;/p-1