(2,3-dimethyl-4-methylsulfanyl-phenyl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2,3-dimethyl-4-methylsulfanyl-phenyl) tris(fluoranyl)methanesulfonate Openeye Name: (2,3-dimethyl-4-methylsulfanyl-phenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2,3-dimethyl-4-(methylthio)phenyl] ester IUPAC Name: (2,3-dimethyl-4-methylsulfanylphenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2,3-dimethyl-4-(methylthio)phenyl] ester Formula: C10H11F3O3S2 MolecularWeight: 300.31775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)SC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1C)SC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C10H11F3O3S2/c1-6-7(2)9(17-3)5-4-8(6)16-18(14,15)10(11,12)13/h4-5H,1-3H3