5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoic acid

Systemtic Name: 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoic acid Openeye Name: 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoic acid CAS Name: 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoic acid IUPAC Name: 5-(trifluoromethyl)-2-(trifluoromethylsulfonylamino)benzoic acid Traditional Name: 5-(trifluoromethyl)-2-(triflylamino)benzoic acid Formula: C9H5F6NO4S MolecularWeight: 337.195719

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)C(=O)O)NS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)C(=O)O)NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H5F6NO4S/c10-8(11,12)4-1-2-6(5(3-4)7(17)18)16-21(19,20)9(13,14)15/h1-3,16H,(H,17,18)