dimethyl-(4-methylphenyl)sulfanium; 1,1,2,3,3,3-hexakis(fluoranyl)propane-1-sulfonate

Systemtic Name: dimethyl-(4-methylphenyl)sulfanium; 1,1,2,3,3,3-hexakis(fluoranyl)propane-1-sulfonate Openeye Name: dimethyl(p-tolyl)sulfonium; 1,1,2,3,3,3-hexafluoropropane-1-sulfonate CAS Name: dimethyl-(4-methylphenyl)sulfonium; 1,1,2,3,3,3-hexafluoro-1-propanesulfonate IUPAC Name: dimethyl-(4-methylphenyl)sulfanium; 1,1,2,3,3,3-hexafluoropropane-1-sulfonate Traditional Name: dimethyl(p-tolyl)sulfonium; 1,1,2,3,3,3-hexafluoropropane-1-sulfonate Formula: C12H14F6O3S2 MolecularWeight: 384.358179

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13S.C3H2F6O3S/c1-8-4-6-9(7-5-8)10(2)3;4-1(2(5,6)7)3(8,9)13(10,11)12/h4-7H,1-3H3;1H,(H,10,11,12)/q+1;/p-1