1-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-5-methyl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 1-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-5-methyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 1-(2-bromo-4,6-difluoro-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(2-bromo-4,6-difluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(2-bromo-4,6-difluorophenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 1-(2-bromo-4,6-difluoro-phenyl)-5-methyl-1,2,4-triazole-3-carboxylic acid Formula: C10H6BrF2N3O2 MolecularWeight: 318.074346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=C(C=C(C=C2Br)F)F)C(=O)O

Isomeric SMILES

CC1=NC(=NN1C2=C(C=C(C=C2Br)F)F)C(=O)O

InChI

InChI=1S/C10H6BrF2N3O2/c1-4-14-9(10(17)18)15-16(4)8-6(11)2-5(12)3-7(8)13/h2-3H,1H3,(H,17,18)