4-bromanyl-6-methyl-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium

Systemtic Name: 4-bromanyl-6-methyl-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium Openeye Name: 4-bromo-6-methyl-3-oxido-2,1,3-benzoxadiazol-3-ium CAS Name: 4-bromo-6-methyl-3-oxido-2,1,3-benzoxadiazol-3-ium IUPAC Name: 4-bromo-6-methyl-3-oxido-2,1,3-benzoxadiazol-3-ium Traditional Name: 7-bromo-5-methyl-1-oxido-benzofurazan-1-ium Formula: C7H5BrN2O2 MolecularWeight: 229.0308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NO[N+](=C2C(=C1)Br)[O-]

Isomeric SMILES

CC1=CC2=NO[N+](=C2C(=C1)Br)[O-]

InChI

InChI=1S/C7H5BrN2O2/c1-4-2-5(8)7-6(3-4)9-12-10(7)11/h2-3H,1H3