ethyl 6-oxidanylidene-2-[3-oxidanylidene-5-(trifluoromethyl)-1H-pyrazol-2-yl]-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-2-[3-oxidanylidene-5-(trifluoromethyl)-1H-pyrazol-2-yl]-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-oxo-2-[3-oxo-5-(trifluoromethyl)-1H-pyrazol-2-yl]-1H-pyrimidine-5-carboxylate CAS Name: 6-oxo-2-[3-oxo-5-(trifluoromethyl)-1H-pyrazol-2-yl]-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-oxo-2-[3-oxo-5-(trifluoromethyl)-1H-pyrazol-2-yl]-1H-pyrimidine-5-carboxylate Traditional Name: 6-keto-2-[5-keto-3-(trifluoromethyl)-3-pyrazolin-1-yl]-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C11H9F3N4O4 MolecularWeight: 318.20877

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(NC1=O)N2C(=O)C=C(N2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CN=C(NC1=O)N2C(=O)C=C(N2)C(F)(F)F

InChI

InChI=1S/C11H9F3N4O4/c1-2-22-9(21)5-4-15-10(16-8(5)20)18-7(19)3-6(17-18)11(12,13)14/h3-4,17H,2H2,1H3,(H,15,16,20)