[4-(4-diphenylsulfoniophenoxy)phenyl]-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(4-diphenylsulfoniophenoxy)phenyl]-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: [4-(4-diphenylsulfoniophenoxy)phenyl]-diphenyl-sulfonium; trifluoromethanesulfonate CAS Name: [4-(4-diphenylsulfoniophenoxy)phenyl]-diphenylsulfonium; trifluoromethanesulfonate IUPAC Name: [4-(4-diphenylsulfoniophenoxy)phenyl]-diphenylsulfanium; trifluoromethanesulfonate Traditional Name: [4-(4-diphenylsulfoniophenoxy)phenyl]-diphenyl-sulfonium ditriflate Formula: C38H28F6O7S4 MolecularWeight: 838.875139

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=C(C=C4)[S+](C5=CC=CC=C5)C6=CC=CC=C6.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)OC4=CC=C(C=C4)[S+](C5=CC=CC=C5)C6=CC=CC=C6.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C36H28OS2.2CHF3O3S/c1-5-13-31(14-6-1)38(32-15-7-2-8-16-32)35-25-21-29(22-26-35)37-30-23-27-36(28-24-30)39(33-17-9-3-10-18-33)34-19-11-4-12-20-34;2*2-1(3,4)8(5,6)7/h1-28H;2*(H,5,6,7)/q+2;;/p-2