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

Systemtic Name: methyl 5-azanyl-1-[3-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 5-amino-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylate CAS Name: 5-amino-1-[3-(trifluoromethyl)phenyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylate Traditional Name: 5-amino-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylic acid methyl ester Formula: C11H9F3N4O2 MolecularWeight: 286.20997

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)C2=CC=CC(=C2)C(F)(F)F)N

Isomeric SMILES

COC(=O)C1=C(N(N=N1)C2=CC=CC(=C2)C(F)(F)F)N

InChI

InChI=1S/C11H9F3N4O2/c1-20-10(19)8-9(15)18(17-16-8)7-4-2-3-6(5-7)11(12,13)14/h2-5H,15H2,1H3