methyl 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoate

Systemtic Name: methyl 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoate Openeye Name: methyl 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoate CAS Name: 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoic acid methyl ester IUPAC Name: methyl 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoate Traditional Name: 5-(trifluoromethyl)-2-(triflylamino)benzoic acid methyl ester Formula: C10H7F6NO4S MolecularWeight: 351.222299

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)C(F)(F)F)NS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)C(F)(F)F)NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C10H7F6NO4S/c1-21-8(18)6-4-5(9(11,12)13)2-3-7(6)17-22(19,20)10(14,15)16/h2-4,17H,1H3