(4-bromanyl-2-chloranyl-phenyl) 1-(phenylmethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: (4-bromanyl-2-chloranyl-phenyl) 1-(phenylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: (4-bromo-2-chloro-phenyl) 1-benzyltriazole-4-carboxylate CAS Name: 1-(phenylmethyl)-4-triazolecarboxylic acid (4-bromo-2-chlorophenyl) ester IUPAC Name: (4-bromo-2-chlorophenyl) 1-benzyltriazole-4-carboxylate Traditional Name: 1-benzyltriazole-4-carboxylic acid (4-bromo-2-chloro-phenyl) ester Formula: C16H11BrClN3O2 MolecularWeight: 392.63444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=N2)C(=O)OC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=N2)C(=O)OC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C16H11BrClN3O2/c17-12-6-7-15(13(18)8-12)23-16(22)14-10-21(20-19-14)9-11-4-2-1-3-5-11/h1-8,10H,9H2