ethyl 5-(3-methylbutyl)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate

Systemtic Name: ethyl 5-(3-methylbutyl)-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate Openeye Name: ethyl 3-hydroxy-5-isopentyl-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate CAS Name: 3-hydroxy-5-(3-methylbutyl)-3-(trifluoromethyl)-1H-pyrazole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-5-(3-methylbutyl)-3-(trifluoromethyl)-1H-pyrazole-2-carboxylate Traditional Name: 5-hydroxy-3-isoamyl-5-(trifluoromethyl)-3-pyrazoline-1-carboxylic acid ethyl ester Formula: C12H19F3N2O3 MolecularWeight: 296.28607

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C=C(N1)CCC(C)C)(C(F)(F)F)O

Isomeric SMILES

CCOC(=O)N1C(C=C(N1)CCC(C)C)(C(F)(F)F)O

InChI

InChI=1S/C12H19F3N2O3/c1-4-20-10(18)17-11(19,12(13,14)15)7-9(16-17)6-5-8(2)3/h7-8,16,19H,4-6H2,1-3H3