ethyl 5-oxidanylidene-1-[2,2,2-tris(fluoranyl)ethyl]-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-1-[2,2,2-tris(fluoranyl)ethyl]-4H-pyrazole-3-carboxylate Openeye Name: ethyl 5-oxo-1-(2,2,2-trifluoroethyl)-4H-pyrazole-3-carboxylate CAS Name: 5-oxo-1-(2,2,2-trifluoroethyl)-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-1-(2,2,2-trifluoroethyl)-4H-pyrazole-3-carboxylate Traditional Name: 5-keto-1-(2,2,2-trifluoroethyl)-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C8H9F3N2O3 MolecularWeight: 238.16387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9F3N2O3/c1-2-16-7(15)5-3-6(14)13(12-5)4-8(9,10)11/h2-4H2,1H3