8-bromanyl-5,6-dimethyl-4-oxidanidyl-1,2,3,4-benzotetrazin-4-ium

Systemtic Name: 8-bromanyl-5,6-dimethyl-4-oxidanidyl-1,2,3,4-benzotetrazin-4-ium Openeye Name: 8-bromo-5,6-dimethyl-4-oxido-1,2,3,4-benzotetrazin-4-ium CAS Name: 8-bromo-5,6-dimethyl-4-oxido-1,2,3,4-benzotetrazin-4-ium IUPAC Name: 8-bromo-5,6-dimethyl-4-oxido-1,2,3,4-benzotetrazin-4-ium Traditional Name: 8-bromo-5,6-dimethyl-4-oxido-1,2,3,4-benzotetrazin-4-ium Formula: C8H7BrN4O MolecularWeight: 255.07138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1C)[N+](=NN=N2)[O-])Br

Isomeric SMILES

CC1=CC(=C2C(=C1C)[N+](=NN=N2)[O-])Br

InChI

InChI=1S/C8H7BrN4O/c1-4-3-6(9)7-8(5(4)2)13(14)12-11-10-7/h3H,1-2H3