1,2-dimethyl-5-[[(6-methylpyridin-1-ium-2-yl)amino]methyl]pyrimidin-1-ium-4-amine diperchlorate

Systemtic Name: 1,2-dimethyl-5-[[(6-methylpyridin-1-ium-2-yl)amino]methyl]pyrimidin-1-ium-4-amine diperchlorate Openeye Name: 1,2-dimethyl-5-[[(6-methylpyridin-1-ium-2-yl)amino]methyl]pyrimidin-1-ium-4-amine diperchlorate CAS Name: 1,2-dimethyl-5-[[(6-methyl-2-pyridin-1-iumyl)amino]methyl]-4-pyrimidin-1-iumamine diperchlorate IUPAC Name: 1,2-dimethyl-5-[[(6-methylpyridin-1-ium-2-yl)amino]methyl]pyrimidin-1-ium-4-amine diperchlorate Traditional Name: (4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl-(6-methylpyridin-1-ium-2-yl)amine diperchlorate Formula: C13H19Cl2N5O8 MolecularWeight: 444.22466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)NCC2=C[N+](=C(N=C2N)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[NH+]C(=CC=C1)NCC2=C[N+](=C(N=C2N)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H17N5.2ClHO4/c1-9-5-4-6-12(16-9)15-7-11-8-18(3)10(2)17-13(11)14;2*2-1(3,4)5/h4-6,8,14H,7H2,1-3H3,(H,15,16);2*(H,2,3,4,5)