2-[5-[(4-bromanylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]ethanoic acid

Systemtic Name: 2-[5-[(4-bromanylphenoxy)methyl]-1H-1,2,4-triazol-3-yl]ethanoic acid Openeye Name: 2-[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]acetic acid CAS Name: 2-[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]acetic acid IUPAC Name: 2-[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]acetic acid Traditional Name: 2-[5-[(4-bromophenoxy)methyl]-1H-1,2,4-triazol-3-yl]acetic acid Formula: C11H10BrN3O3 MolecularWeight: 312.1194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC2=NC(=NN2)CC(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1OCC2=NC(=NN2)CC(=O)O)Br

InChI

InChI=1S/C11H10BrN3O3/c12-7-1-3-8(4-2-7)18-6-10-13-9(14-15-10)5-11(16)17/h1-4H,5-6H2,(H,16,17)(H,13,14,15)