1-methyl-5-(trifluoromethylsulfonylamino)pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-(trifluoromethylsulfonylamino)pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-(trifluoromethylsulfonylamino)pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-(trifluoromethylsulfonylamino)-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-(trifluoromethylsulfonylamino)pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-(triflylamino)pyrazole-4-carboxylic acid Formula: C6H6F3N3O4S MolecularWeight: 273.18975

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)NS(=O)(=O)C(F)(F)F

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)NS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C6H6F3N3O4S/c1-12-4(3(2-10-12)5(13)14)11-17(15,16)6(7,8)9/h2,11H,1H3,(H,13,14)