ethyl 4,4,4-tris(fluoranyl)-3-(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-4-yl)-3-oxidanyl-butanoate

Systemtic Name: ethyl 4,4,4-tris(fluoranyl)-3-(3-methyl-5-oxidanylidene-1,4-dihydropyrazol-4-yl)-3-oxidanyl-butanoate Openeye Name: ethyl 4,4,4-trifluoro-3-hydroxy-3-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)butanoate CAS Name: 4,4,4-trifluoro-3-hydroxy-3-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4,4,4-trifluoro-3-hydroxy-3-(3-methyl-5-oxo-1,4-dihydropyrazol-4-yl)butanoate Traditional Name: 4,4,4-trifluoro-3-hydroxy-3-(3-keto-5-methyl-2-pyrazolin-4-yl)butyric acid ethyl ester Formula: C10H13F3N2O4 MolecularWeight: 282.21643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1C(=NNC1=O)C)(C(F)(F)F)O

Isomeric SMILES

CCOC(=O)CC(C1C(=NNC1=O)C)(C(F)(F)F)O

InChI

InChI=1S/C10H13F3N2O4/c1-3-19-6(16)4-9(18,10(11,12)13)7-5(2)14-15-8(7)17/h7,18H,3-4H2,1-2H3,(H,15,17)