1-[2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(4-bromanyl-2-chloranyl-6-methyl-phenoxy)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(4-bromo-2-chloro-6-methyl-phenoxy)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(4-bromo-2-chloro-6-methylphenoxy)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(4-bromo-2-chloro-6-methylphenoxy)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(4-bromo-2-chloro-6-methyl-phenoxy)ethyl]triazole-4-carboxylic acid Formula: C12H11BrClN3O3 MolecularWeight: 360.59104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCN2C=C(N=N2)C(=O)O)Cl)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCCN2C=C(N=N2)C(=O)O)Cl)Br

InChI

InChI=1S/C12H11BrClN3O3/c1-7-4-8(13)5-9(14)11(7)20-3-2-17-6-10(12(18)19)15-16-17/h4-6H,2-3H2,1H3,(H,18,19)