3-(2-acetamidophenyl)-4-bromanyl-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-(2-acetamidophenyl)-4-bromanyl-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-(2-acetamidophenyl)-4-bromo-oxadiazol-3-ium-5-olate CAS Name: 3-(2-acetamidophenyl)-4-bromo-5-oxadiazol-3-iumolate IUPAC Name: 3-(2-acetamidophenyl)-4-bromooxadiazol-3-ium-5-olate Traditional Name: 3-(2-acetamidophenyl)-4-bromo-oxadiazol-3-ium-5-olate Formula: C10H8BrN3O3 MolecularWeight: 298.09282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1[N+]2=NOC(=C2Br)[O-]

Isomeric SMILES

CC(=O)NC1=CC=CC=C1[N+]2=NOC(=C2Br)[O-]

InChI

InChI=1S/C10H8BrN3O3/c1-6(15)12-7-4-2-3-5-8(7)14-9(11)10(16)17-13-14/h2-5H,1H3,(H-,12,13,15,16)