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

Systemtic Name: 1-[2-(4-bromanyl-2-chloranyl-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(4-bromo-2-chlorophenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(4-bromo-2-chlorophenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(4-bromo-2-chloro-phenoxy)ethyl]triazole-4-carboxylic acid Formula: C11H9BrClN3O3 MolecularWeight: 346.56446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)Cl)OCCN2C=C(N=N2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Br)Cl)OCCN2C=C(N=N2)C(=O)O

InChI

InChI=1S/C11H9BrClN3O3/c12-7-1-2-10(8(13)5-7)19-4-3-16-6-9(11(17)18)14-15-16/h1-2,5-6H,3-4H2,(H,17,18)