4-bromanyl-2-phenyl-1H-1,2,3-triazol-5-one

Systemtic Name: 4-bromanyl-2-phenyl-1H-1,2,3-triazol-5-one Openeye Name: 4-bromo-2-phenyl-1H-triazol-5-one CAS Name: 4-bromo-2-phenyl-1H-triazol-5-one IUPAC Name: 4-bromo-2-phenyl-1H-triazol-5-one Traditional Name: 4-bromo-2-phenyl-1H-triazol-5-one Formula: C8H6BrN3O MolecularWeight: 240.05674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2NC(=O)C(=N2)Br

Isomeric SMILES

C1=CC=C(C=C1)N2NC(=O)C(=N2)Br

InChI

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