methyl 4-fluoranyl-2-(trifluoromethylsulfanyl)benzenesulfonate

Systemtic Name: methyl 4-fluoranyl-2-(trifluoromethylsulfanyl)benzenesulfonate Openeye Name: methyl 4-fluoro-2-(trifluoromethylsulfanyl)benzenesulfonate CAS Name: 4-fluoro-2-(trifluoromethylthio)benzenesulfonic acid methyl ester IUPAC Name: methyl 4-fluoro-2-(trifluoromethylsulfanyl)benzenesulfonate Traditional Name: 4-fluoro-2-(trifluoromethylthio)benzenesulfonic acid methyl ester Formula: C8H6F4O3S2 MolecularWeight: 290.255053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=C(C=C(C=C1)F)SC(F)(F)F

Isomeric SMILES

COS(=O)(=O)C1=C(C=C(C=C1)F)SC(F)(F)F

InChI

InChI=1S/C8H6F4O3S2/c1-15-17(13,14)7-3-2-5(9)4-6(7)16-8(10,11)12/h2-4H,1H3