(2-ethylphenyl)-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (2-ethylphenyl)-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: (2-ethylphenyl)-diphenyl-sulfonium; trifluoromethanesulfonate CAS Name: (2-ethylphenyl)-diphenylsulfonium; trifluoromethanesulfonate IUPAC Name: (2-ethylphenyl)-diphenylsulfanium; trifluoromethanesulfonate Traditional Name: (2-ethylphenyl)-diphenyl-sulfonium triflate Formula: C21H19F3O3S2 MolecularWeight: 440.49897

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C20H19S.CHF3O3S/c1-2-17-11-9-10-16-20(17)21(18-12-5-3-6-13-18)19-14-7-4-8-15-19;2-1(3,4)8(5,6)7/h3-16H,2H2,1H3;(H,5,6,7)/q+1;/p-1