1-(5-bromanyl-2-fluoranyl-phenyl)-5-ethyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(5-bromanyl-2-fluoranyl-phenyl)-5-ethyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(5-bromo-2-fluoro-phenyl)-5-ethyl-triazole-4-carboxylic acid CAS Name: 1-(5-bromo-2-fluorophenyl)-5-ethyl-4-triazolecarboxylic acid IUPAC Name: 1-(5-bromo-2-fluorophenyl)-5-ethyltriazole-4-carboxylic acid Traditional Name: 1-(5-bromo-2-fluoro-phenyl)-5-ethyl-triazole-4-carboxylic acid Formula: C11H9BrFN3O2 MolecularWeight: 314.110463

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=NN1C2=C(C=CC(=C2)Br)F)C(=O)O

Isomeric SMILES

CCC1=C(N=NN1C2=C(C=CC(=C2)Br)F)C(=O)O

InChI

InChI=1S/C11H9BrFN3O2/c1-2-8-10(11(17)18)14-15-16(8)9-5-6(12)3-4-7(9)13/h3-5H,2H2,1H3,(H,17,18)