5-methyl-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-methyl-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-methyl-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxylic acid CAS Name: 5-methyl-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxylic acid IUPAC Name: 5-methyl-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxylic acid Traditional Name: 5-methyl-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxylic acid Formula: C11H8F3N3O2 MolecularWeight: 271.19533

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=CC=C2C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(N=NN1C2=CC=CC=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C11H8F3N3O2/c1-6-9(10(18)19)15-16-17(6)8-5-3-2-4-7(8)11(12,13)14/h2-5H,1H3,(H,18,19)