1-(2-cyano-3-fluoranyl-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 1-(2-cyano-3-fluoranyl-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 1-(2-cyano-3-fluoro-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(2-cyano-3-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(2-cyano-3-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 1-(2-cyano-3-fluoro-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Formula: C11H7FN4O2 MolecularWeight: 246.197283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=C(C(=CC=C2)F)C#N)C(=O)O

Isomeric SMILES

CC1=NC(=NN1C2=C(C(=CC=C2)F)C#N)C(=O)O

InChI

InChI=1S/C11H7FN4O2/c1-6-14-10(11(17)18)15-16(6)9-4-2-3-8(12)7(9)5-13/h2-4H,1H3,(H,17,18)