1-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(2-bromanyl-4-fluoranyl-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(2-bromo-4-fluoro-phenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(2-bromo-4-fluorophenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(2-bromo-4-fluorophenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(2-bromo-4-fluoro-phenoxy)ethyl]triazole-4-carboxylic acid Formula: C11H9BrFN3O3 MolecularWeight: 330.109863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)Br)OCCN2C=C(N=N2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1F)Br)OCCN2C=C(N=N2)C(=O)O

InChI

InChI=1S/C11H9BrFN3O3/c12-8-5-7(13)1-2-10(8)19-4-3-16-6-9(11(17)18)14-15-16/h1-2,5-6H,3-4H2,(H,17,18)