2-(2-azanyl-5-phenyl-1,3,4-oxadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(2-azanyl-5-phenyl-1,3,4-oxadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(2-amino-5-phenyl-1,3,4-oxadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide CAS Name: 2-(2-amino-5-phenyl-1,3,4-oxadiazol-3-ium-3-yl)-1-phenylethanone bromide IUPAC Name: 2-(2-amino-5-phenyl-1,3,4-oxadiazol-3-ium-3-yl)-1-phenylethanone bromide Traditional Name: 2-(2-amino-5-phenyl-1,3,4-oxadiazol-3-ium-3-yl)-1-phenyl-ethanone bromide Formula: C16H14BrN3O2 MolecularWeight: 360.20526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=N[N+](=C(O2)N)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=N[N+](=C(O2)N)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C16H13N3O2.BrH/c17-16-19(11-14(20)12-7-3-1-4-8-12)18-15(21-16)13-9-5-2-6-10-13;/h1-10,17H,11H2;1H