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

Systemtic Name: methyl 3-tert-butyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate Openeye Name: methyl 3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate CAS Name: 3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazole-1-carboxylic acid methyl ester IUPAC Name: methyl 3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate Traditional Name: 3-tert-butyl-5-hydroxy-5-(trifluoromethyl)-2-pyrazoline-1-carboxylic acid methyl ester Formula: C10H15F3N2O3 MolecularWeight: 268.23291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(C1)(C(F)(F)F)O)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=NN(C(C1)(C(F)(F)F)O)C(=O)OC

InChI

InChI=1S/C10H15F3N2O3/c1-8(2,3)6-5-9(17,10(11,12)13)15(14-6)7(16)18-4/h17H,5H2,1-4H3