ethyl 2-[(E)-(oxidanylamino)methylideneamino]-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[(E)-(oxidanylamino)methylideneamino]-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[(E)-(hydroxyamino)methyleneamino]-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[(E)-(hydroxyamino)methylideneamino]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-(hydroxyamino)methylideneamino]-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[(E)-(hydroxyamino)methyleneamino]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C9H9F3N4O3 MolecularWeight: 278.18797

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)N=CNO

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C(F)(F)F)/N=C/NO

InChI

InChI=1S/C9H9F3N4O3/c1-2-19-7(17)5-3-13-8(14-4-15-18)16-6(5)9(10,11)12/h3-4,18H,2H2,1H3,(H,13,14,15,16)