methyl 5-oxidanyl-3-phenyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate

Systemtic Name: methyl 5-oxidanyl-3-phenyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate Openeye Name: methyl 5-hydroxy-3-phenyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate CAS Name: 5-hydroxy-3-phenyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylic acid methyl ester IUPAC Name: methyl 5-hydroxy-3-phenyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate Traditional Name: 5-hydroxy-3-phenyl-5-(trifluoromethyl)-2-pyrazoline-1-carboxylic acid methyl ester Formula: C12H11F3N2O3 MolecularWeight: 288.22255

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(CC(=N1)C2=CC=CC=C2)(C(F)(F)F)O

Isomeric SMILES

COC(=O)N1C(CC(=N1)C2=CC=CC=C2)(C(F)(F)F)O

InChI

InChI=1S/C12H11F3N2O3/c1-20-10(18)17-11(19,12(13,14)15)7-9(16-17)8-5-3-2-4-6-8/h2-6,19H,7H2,1H3