5-(3-bromophenyl)-1H-1,2,4-triazol-3-olate

Systemtic Name: 5-(3-bromophenyl)-1H-1,2,4-triazol-3-olate Openeye Name: 5-(3-bromophenyl)-1H-1,2,4-triazol-3-olate CAS Name: 5-(3-bromophenyl)-1H-1,2,4-triazol-3-olate IUPAC Name: 5-(3-bromophenyl)-1H-1,2,4-triazol-3-olate Traditional Name: 5-(3-bromophenyl)-1H-1,2,4-triazol-3-olate Formula: C8H5BrN3O- MolecularWeight: 239.0488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C2=NC(=NN2)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C2=NC(=NN2)[O-]

InChI

InChI=1S/C8H6BrN3O/c9-6-3-1-2-5(4-6)7-10-8(13)12-11-7/h1-4H,(H2,10,11,12,13)/p-1