3-(3-bromanyl-4-methyl-phenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine

Systemtic Name: 3-(3-bromanyl-4-methyl-phenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine Openeye Name: 3-(3-bromo-4-methyl-phenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine CAS Name: 3-(3-bromo-4-methylphenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine IUPAC Name: 3-(3-bromo-4-methylphenyl)-4,4-dimethyl-1H-1,3,5-triazin-3-ium-2,6-diamine Traditional Name: [6-amino-3-(3-bromo-4-methyl-phenyl)-4,4-dimethyl-1H-s-triazin-3-ium-2-yl]amine Formula: C12H17BrN5+ MolecularWeight: 311.20088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+]2=C(NC(=NC2(C)C)N)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1)[N+]2=C(NC(=NC2(C)C)N)N)Br

InChI

InChI=1S/C12H16BrN5/c1-7-4-5-8(6-9(7)13)18-11(15)16-10(14)17-12(18,2)3/h4-6H,1-3H3,(H4,14,15,16,17)/p+1