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

Systemtic Name: ethyl 5-oxidanylidene-3-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazine-6-carboxylate Openeye Name: ethyl 5-oxo-3-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazine-6-carboxylate CAS Name: 5-oxo-3-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-3-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazine-6-carboxylate Traditional Name: 5-keto-3-[3-(trifluoromethyl)phenyl]-2H-1,2,4-triazine-6-carboxylic acid ethyl ester Formula: C13H10F3N3O3 MolecularWeight: 313.23201

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=NC1=O)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=NNC(=NC1=O)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C13H10F3N3O3/c1-2-22-12(21)9-11(20)17-10(19-18-9)7-4-3-5-8(6-7)13(14,15)16/h3-6H,2H2,1H3,(H,17,19,20)