methyl 5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-2H-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]-2H-1,2,3-triazole-4-carboxylate Openeye Name: methyl 5-oxo-1-[3-(trifluoromethyl)phenyl]-2H-triazole-4-carboxylate CAS Name: 5-oxo-1-[3-(trifluoromethyl)phenyl]-2H-triazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-oxo-1-[3-(trifluoromethyl)phenyl]-2H-triazole-4-carboxylate Traditional Name: 5-keto-1-[3-(trifluoromethyl)phenyl]-2H-triazole-4-carboxylic acid methyl ester Formula: C11H8F3N3O3 MolecularWeight: 287.19473

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNN(C1=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

COC(=O)C1=NNN(C1=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C11H8F3N3O3/c1-20-10(19)8-9(18)17(16-15-8)7-4-2-3-6(5-7)11(12,13)14/h2-5,16H,1H3