methyl 2-methylsulfanyl-6-(trifluoromethyl)benzenesulfonate

Systemtic Name: methyl 2-methylsulfanyl-6-(trifluoromethyl)benzenesulfonate Openeye Name: methyl 2-methylsulfanyl-6-(trifluoromethyl)benzenesulfonate CAS Name: 2-(methylthio)-6-(trifluoromethyl)benzenesulfonic acid methyl ester IUPAC Name: methyl 2-methylsulfanyl-6-(trifluoromethyl)benzenesulfonate Traditional Name: 2-(methylthio)-6-(trifluoromethyl)benzenesulfonic acid methyl ester Formula: C9H9F3O3S2 MolecularWeight: 286.29117

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=C(C=CC=C1SC)C(F)(F)F

Isomeric SMILES

COS(=O)(=O)C1=C(C=CC=C1SC)C(F)(F)F

InChI

InChI=1S/C9H9F3O3S2/c1-15-17(13,14)8-6(9(10,11)12)4-3-5-7(8)16-2/h3-5H,1-2H3