2-[1-(3-bromophenyl)-5-methyl-1,2,3-triazol-4-yl]ethanoate

Systemtic Name: 2-[1-(3-bromophenyl)-5-methyl-1,2,3-triazol-4-yl]ethanoate Openeye Name: 2-[1-(3-bromophenyl)-5-methyl-triazol-4-yl]acetate CAS Name: 2-[1-(3-bromophenyl)-5-methyl-4-triazolyl]acetate IUPAC Name: 2-[1-(3-bromophenyl)-5-methyltriazol-4-yl]acetate Traditional Name: 2-[1-(3-bromophenyl)-5-methyl-triazol-4-yl]acetate Formula: C11H9BrN3O2- MolecularWeight: 295.11206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC(=CC=C2)Br)CC(=O)[O-]

Isomeric SMILES

CC1=C(N=NN1C2=CC(=CC=C2)Br)CC(=O)[O-]

InChI

InChI=1S/C11H10BrN3O2/c1-7-10(6-11(16)17)13-14-15(7)9-4-2-3-8(12)5-9/h2-5H,6H2,1H3,(H,16,17)/p-1