3-(2-bromophenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine chloride

Systemtic Name: 3-(2-bromophenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine chloride Openeye Name: 3-(2-bromophenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine chloride CAS Name: 3-(2-bromophenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine chloride IUPAC Name: 3-(2-bromophenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine chloride Traditional Name: [6-amino-3-(2-bromophenyl)-4,4-dimethyl-1H-s-triazin-3-ium-2-yl]amine chloride Formula: C11H15BrClN5 MolecularWeight: 332.6273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(NC(=[N+]1C2=CC=CC=C2Br)N)N)C.[Cl-]

Isomeric SMILES

CC1(N=C(NC(=[N+]1C2=CC=CC=C2Br)N)N)C.[Cl-]

InChI

InChI=1S/C11H14BrN5.ClH/c1-11(2)16-9(13)15-10(14)17(11)8-6-4-3-5-7(8)12;/h3-6H,1-2H3,(H4,13,14,15,16);1H