[2,3-bis(4-methylphenyl)phenyl]sulfanium; 1,1,2,3,3,3-hexakis(fluoranyl)propane-1-sulfonate

Systemtic Name: [2,3-bis(4-methylphenyl)phenyl]sulfanium; 1,1,2,3,3,3-hexakis(fluoranyl)propane-1-sulfonate Openeye Name: [2,3-bis(p-tolyl)phenyl]sulfonium; 1,1,2,3,3,3-hexafluoropropane-1-sulfonate CAS Name: [2,3-bis(4-methylphenyl)phenyl]sulfonium; 1,1,2,3,3,3-hexafluoro-1-propanesulfonate IUPAC Name: [2,3-bis(4-methylphenyl)phenyl]sulfanium; 1,1,2,3,3,3-hexafluoropropane-1-sulfonate Traditional Name: [2,3-bis(p-tolyl)phenyl]sulfonium; 1,1,2,3,3,3-hexafluoropropane-1-sulfonate Formula: C23H20F6O3S2 MolecularWeight: 522.523519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=CC=C2)[SH2+])C3=CC=C(C=C3)C.C(C(F)(F)F)(C(F)(F)S(=O)(=O)[O-])F

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=CC=C2)[SH2+])C3=CC=C(C=C3)C.C(C(F)(F)F)(C(F)(F)S(=O)(=O)[O-])F

InChI

InChI=1S/C20H18S.C3H2F6O3S/c1-14-6-10-16(11-7-14)18-4-3-5-19(21)20(18)17-12-8-15(2)9-13-17;4-1(2(5,6)7)3(8,9)13(10,11)12/h3-13,21H,1-2H3;1H,(H,10,11,12)