methyl 5-oxidanyl-5-(trifluoromethyl)-1,4-dihydropyrazole-3-carboxylate

Systemtic Name: methyl 5-oxidanyl-5-(trifluoromethyl)-1,4-dihydropyrazole-3-carboxylate Openeye Name: methyl 5-hydroxy-5-(trifluoromethyl)-1,4-dihydropyrazole-3-carboxylate CAS Name: 5-hydroxy-5-(trifluoromethyl)-1,4-dihydropyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-5-(trifluoromethyl)-1,4-dihydropyrazole-3-carboxylate Traditional Name: 5-hydroxy-5-(trifluoromethyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C6H7F3N2O3 MolecularWeight: 212.12659

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNC(C1)(C(F)(F)F)O

Isomeric SMILES

COC(=O)C1=NNC(C1)(C(F)(F)F)O

InChI

InChI=1S/C6H7F3N2O3/c1-14-4(12)3-2-5(13,11-10-3)6(7,8)9/h11,13H,2H2,1H3