5-bromanyl-1-oxidanidyl-2-phenyl-benzotriazol-1-ium

Systemtic Name: 5-bromanyl-1-oxidanidyl-2-phenyl-benzotriazol-1-ium Openeye Name: 5-bromo-1-oxido-2-phenyl-benzotriazol-1-ium CAS Name: 5-bromo-1-oxido-2-phenylbenzotriazol-1-ium IUPAC Name: 5-bromo-1-oxido-2-phenylbenzotriazol-1-ium Traditional Name: 5-bromo-1-oxido-2-phenyl-benzotriazol-1-ium Formula: C12H8BrN3O MolecularWeight: 290.11542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=C(C=CC3=[N+]2[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=C(C=CC3=[N+]2[O-])Br

InChI

InChI=1S/C12H8BrN3O/c13-9-6-7-12-11(8-9)14-15(16(12)17)10-4-2-1-3-5-10/h1-8H