diphenyl-(2,4,6-trimethylphenyl)sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: diphenyl-(2,4,6-trimethylphenyl)sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: diphenyl-(2,4,6-trimethylphenyl)sulfonium; trifluoromethanesulfonate CAS Name: diphenyl-(2,4,6-trimethylphenyl)sulfonium; trifluoromethanesulfonate IUPAC Name: diphenyl-(2,4,6-trimethylphenyl)sulfanium; trifluoromethanesulfonate Traditional Name: mesityl(diphenyl)sulfonium triflate Formula: C22H21F3O3S2 MolecularWeight: 454.52555

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21S.CHF3O3S/c1-16-14-17(2)21(18(3)15-16)22(19-10-6-4-7-11-19)20-12-8-5-9-13-20;2-1(3,4)8(5,6)7/h4-15H,1-3H3;(H,5,6,7)/q+1;/p-1