(3,5-dimethyl-4-oxidanyl-phenyl)-dimethyl-sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate

Systemtic Name: (3,5-dimethyl-4-oxidanyl-phenyl)-dimethyl-sulfanium; 1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonate Openeye Name: (4-hydroxy-3,5-dimethyl-phenyl)-dimethyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate CAS Name: (4-hydroxy-3,5-dimethylphenyl)-dimethylsulfonium; 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonate IUPAC Name: (4-hydroxy-3,5-dimethylphenyl)-dimethylsulfanium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Traditional Name: (4-hydroxy-3,5-dimethyl-phenyl)-dimethyl-sulfonium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate Formula: C14H15F9O4S2 MolecularWeight: 482.382129

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)[S+](C)C.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

Isomeric SMILES

CC1=CC(=CC(=C1O)C)[S+](C)C.C(C(C(F)(F)S(=O)(=O)[O-])(F)F)(C(F)(F)F)(F)F

InChI

InChI=1S/C10H14OS.C4HF9O3S/c1-7-5-9(12(3)4)6-8(2)10(7)11;5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h5-6H,1-4H3;(H,14,15,16)