2-methyl-4-methylsulfonyl-3-(trifluoromethylsulfonyloxy)benzoate

Systemtic Name: 2-methyl-4-methylsulfonyl-3-(trifluoromethylsulfonyloxy)benzoate Openeye Name: 2-methyl-4-methylsulfonyl-3-(trifluoromethylsulfonyloxy)benzoate CAS Name: 2-methyl-4-methylsulfonyl-3-(trifluoromethylsulfonyloxy)benzoate IUPAC Name: 2-methyl-4-methylsulfonyl-3-(trifluoromethylsulfonyloxy)benzoate Traditional Name: 4-mesyl-2-methyl-3-triflyloxy-benzoate Formula: C10H8F3O7S2- MolecularWeight: 361.29153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OS(=O)(=O)C(F)(F)F)S(=O)(=O)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1OS(=O)(=O)C(F)(F)F)S(=O)(=O)C)C(=O)[O-]

InChI

InChI=1S/C10H9F3O7S2/c1-5-6(9(14)15)3-4-7(21(2,16)17)8(5)20-22(18,19)10(11,12)13/h3-4H,1-2H3,(H,14,15)/p-1