methyl 1-(4-bromophenyl)-5-methyl-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-(4-bromophenyl)-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-(4-bromophenyl)-5-methyl-triazole-4-carboxylate CAS Name: 1-(4-bromophenyl)-5-methyl-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromophenyl)-5-methyltriazole-4-carboxylate Traditional Name: 1-(4-bromophenyl)-5-methyl-triazole-4-carboxylic acid methyl ester Formula: C11H10BrN3O2 MolecularWeight: 296.12

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CC1=C(N=NN1C2=CC=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C11H10BrN3O2/c1-7-10(11(16)17-2)13-14-15(7)9-5-3-8(12)4-6-9/h3-6H,1-2H3