4-[5-(4-bromophenyl)-1,2,3-triazol-1-yl]benzoic acid

Systemtic Name: 4-[5-(4-bromophenyl)-1,2,3-triazol-1-yl]benzoic acid Openeye Name: 4-[5-(4-bromophenyl)triazol-1-yl]benzoic acid CAS Name: 4-[5-(4-bromophenyl)-1-triazolyl]benzoic acid IUPAC Name: 4-[5-(4-bromophenyl)triazol-1-yl]benzoic acid Traditional Name: 4-[5-(4-bromophenyl)triazol-1-yl]benzoic acid Formula: C15H10BrN3O2 MolecularWeight: 344.1628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=NN2C3=CC=C(C=C3)C(=O)O)Br

Isomeric SMILES

C1=CC(=CC=C1C2=CN=NN2C3=CC=C(C=C3)C(=O)O)Br

InChI

InChI=1S/C15H10BrN3O2/c16-12-5-1-10(2-6-12)14-9-17-18-19(14)13-7-3-11(4-8-13)15(20)21/h1-9H,(H,20,21)