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

Systemtic Name: 5-[bis(fluoranyl)methyl]-1-methyl-pyrazole-3-carboxylic acid Openeye Name: 5-(difluoromethyl)-1-methyl-pyrazole-3-carboxylic acid CAS Name: 5-(difluoromethyl)-1-methyl-3-pyrazolecarboxylic acid IUPAC Name: 5-(difluoromethyl)-1-methylpyrazole-3-carboxylic acid Traditional Name: 5-(difluoromethyl)-1-methyl-pyrazole-3-carboxylic acid Formula: C6H6F2N2O2 MolecularWeight: 176.120846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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