methyl 5-cyclohexyl-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate

Systemtic Name: methyl 5-cyclohexyl-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate Openeye Name: methyl 5-cyclohexyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate CAS Name: 5-cyclohexyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-cyclohexyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate Traditional Name: 3-cyclohexyl-5-hydroxy-5-(trifluoromethyl)-3-pyrazoline-1-carboxylic acid methyl ester Formula: C12H17F3N2O3 MolecularWeight: 294.27019

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(C=C(N1)C2CCCCC2)(C(F)(F)F)O

Isomeric SMILES

COC(=O)N1C(C=C(N1)C2CCCCC2)(C(F)(F)F)O

InChI

InChI=1S/C12H17F3N2O3/c1-20-10(18)17-11(19,12(13,14)15)7-9(16-17)8-5-3-2-4-6-8/h7-8,16,19H,2-6H2,1H3