methyl 4-(bromomethyl)benzotriazole-1-carboxylate

Systemtic Name: methyl 4-(bromomethyl)benzotriazole-1-carboxylate Openeye Name: methyl 4-(bromomethyl)benzotriazole-1-carboxylate CAS Name: 4-(bromomethyl)-1-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 4-(bromomethyl)benzotriazole-1-carboxylate Traditional Name: 4-(bromomethyl)benzotriazole-1-carboxylic acid methyl ester Formula: C9H8BrN3O2 MolecularWeight: 270.08272

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C2=CC=CC(=C2N=N1)CBr

Isomeric SMILES

COC(=O)N1C2=CC=CC(=C2N=N1)CBr

InChI

InChI=1S/C9H8BrN3O2/c1-15-9(14)13-7-4-2-3-6(5-10)8(7)11-12-13/h2-4H,5H2,1H3