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3-methoxy-5-methyl-2-(trifluoromethylsulfonyloxy)benzoic acid

3-methoxy-5-methyl-2-(trifluoromethylsulfonyloxy)benzoic acid

Systemtic Name:3-methoxy-5-methyl-2-(trifluoromethylsulfonyloxy)benzoic acid
Openeye Name:3-methoxy-5-methyl-2-(trifluoromethylsulfonyloxy)benzoic acid
CAS Name:3-methoxy-5-methyl-2-(trifluoromethylsulfonyloxy)benzoic acid
IUPAC Name:3-methoxy-5-methyl-2-(trifluoromethylsulfonyloxy)benzoic acid
Traditional Name:3-methoxy-5-methyl-2-triflyloxy-benzoic acid
Formula: C10H9F3O6S
MolecularWeight: 314.23507
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O)OS(=O)(=O)C(F)(F)F)OC


Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O)OS(=O)(=O)C(F)(F)F)OC


InChI

InChI=1S/C10H9F3O6S/c1-5-3-6(9(14)15)8(7(4-5)18-2)19-20(16,17)10(11,12)13/h3-4H,1-2H3,(H,14,15)


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