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

Systemtic Name: 1,2-dimethyl-5-[(4-methylpyridin-1-ium-1-yl)methyl]pyrimidin-1-ium-4-amine diperchlorate Openeye Name: 1,2-dimethyl-5-[(4-methylpyridin-1-ium-1-yl)methyl]pyrimidin-1-ium-4-amine diperchlorate CAS Name: 1,2-dimethyl-5-[(4-methyl-1-pyridin-1-iumyl)methyl]-4-pyrimidin-1-iumamine diperchlorate IUPAC Name: 1,2-dimethyl-5-[(4-methylpyridin-1-ium-1-yl)methyl]pyrimidin-1-ium-4-amine diperchlorate Traditional Name: [1,2-dimethyl-5-[(4-methylpyridin-1-ium-1-yl)methyl]pyrimidin-1-ium-4-yl]amine diperchlorate Formula: C13H18Cl2N4O8 MolecularWeight: 429.21002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CC2=C[N+](=C(N=C2N)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=[N+](C=C1)CC2=C[N+](=C(N=C2N)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H17N4.2ClHO4/c1-10-4-6-17(7-5-10)9-12-8-16(3)11(2)15-13(12)14;2*2-1(3,4)5/h4-8,14H,9H2,1-3H3;2*(H,2,3,4,5)/q+1;;/p-1