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

Systemtic Name: 1-[(4-bromophenyl)methyl]-5-methyl-1,2,3-triazole-4-carboxylate Openeye Name: 1-[(4-bromophenyl)methyl]-5-methyl-triazole-4-carboxylate CAS Name: 1-[(4-bromophenyl)methyl]-5-methyl-4-triazolecarboxylate IUPAC Name: 1-[(4-bromophenyl)methyl]-5-methyltriazole-4-carboxylate Traditional Name: 1-(4-bromobenzyl)-5-methyl-triazole-4-carboxylate Formula: C11H9BrN3O2- MolecularWeight: 295.11206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1CC2=CC=C(C=C2)Br)C(=O)[O-]

Isomeric SMILES

CC1=C(N=NN1CC2=CC=C(C=C2)Br)C(=O)[O-]

InChI

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