1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-amine diperchlorate

Systemtic Name: 1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-amine diperchlorate Openeye Name: 1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-amine diperchlorate CAS Name: 1,2-dimethyl-5-[(3-methyl-1-imidazol-3-iumyl)methyl]-4-pyrimidin-1-iumamine diperchlorate IUPAC Name: 1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-amine diperchlorate Traditional Name: [1,2-dimethyl-5-[(3-methylimidazol-3-ium-1-yl)methyl]pyrimidin-1-ium-4-yl]amine diperchlorate Formula: C11H17Cl2N5O8 MolecularWeight: 418.18738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=N1)N)CN2C=C[N+](=C2)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[N+](C=C(C(=N1)N)CN2C=C[N+](=C2)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C11H16N5.2ClHO4/c1-9-13-11(12)10(6-15(9)3)7-16-5-4-14(2)8-16;2*2-1(3,4)5/h4-6,8,12H,7H2,1-3H3;2*(H,2,3,4,5)/q+1;;/p-1