methyl 3-acetamido-4-(trifluoromethylsulfonyloxy)benzoate

Systemtic Name: methyl 3-acetamido-4-(trifluoromethylsulfonyloxy)benzoate Openeye Name: methyl 3-acetamido-4-(trifluoromethylsulfonyloxy)benzoate CAS Name: 3-acetamido-4-(trifluoromethylsulfonyloxy)benzoic acid methyl ester IUPAC Name: methyl 3-acetamido-4-(trifluoromethylsulfonyloxy)benzoate Traditional Name: 3-acetamido-4-triflyloxy-benzoic acid methyl ester Formula: C11H10F3NO6S MolecularWeight: 341.26041

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)OC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)OC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H10F3NO6S/c1-6(16)15-8-5-7(10(17)20-2)3-4-9(8)21-22(18,19)11(12,13)14/h3-5H,1-2H3,(H,15,16)