ethyl 5-azanyl-6-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-3-carboxylate

Systemtic Name: ethyl 5-azanyl-6-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-3-carboxylate Openeye Name: ethyl 5-amino-6-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-3-carboxylate CAS Name: 5-amino-6-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-6-oxo-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-3-carboxylate Traditional Name: 5-amino-6-keto-1-[3-(trifluoromethyl)phenyl]-1,2,4-triazine-3-carboxylic acid ethyl ester Formula: C13H11F3N4O3 MolecularWeight: 328.24665

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C(=N1)N)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C(=N1)N)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C13H11F3N4O3/c1-2-23-12(22)10-18-9(17)11(21)20(19-10)8-5-3-4-7(6-8)13(14,15)16/h3-6H,2H2,1H3,(H2,17,18,19)