7-bromanyl-5-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 7-bromanyl-5-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 7-bromo-5-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 7-bromo-5-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 7-bromo-5-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (7-bromo-5-methyl-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)amine Formula: C8H7BrN4O MolecularWeight: 255.07138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(N=[N+]2[O-])N)Br

Isomeric SMILES

CC1=CC(=CC2=C1N=C(N=[N+]2[O-])N)Br

InChI

InChI=1S/C8H7BrN4O/c1-4-2-5(9)3-6-7(4)11-8(10)12-13(6)14/h2-3H,1H3,(H2,10,11,12)