3-[bis(fluoranyl)methyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-[bis(fluoranyl)methyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-(difluoromethyl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-(difluoromethyl)-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-(difluoromethyl)-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-(difluoromethyl)-1-methyl-pyrazole-4-carboxylic acid Formula: C6H6F2N2O2 MolecularWeight: 176.120846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H6F2N2O2/c1-10-2-3(6(11)12)4(9-10)5(7)8/h2,5H,1H3,(H,11,12)