1,3-bis[(4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyrimidine-2,4-dione diperchlorate

Systemtic Name: 1,3-bis[(4-azanyl-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyrimidine-2,4-dione diperchlorate Openeye Name: 1,3-bis[(4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyrimidine-2,4-dione diperchlorate CAS Name: 1,3-bis[(4-amino-1,2-dimethyl-5-pyrimidin-1-iumyl)methyl]pyrimidine-2,4-dione diperchlorate IUPAC Name: 1,3-bis[(4-amino-1,2-dimethylpyrimidin-1-ium-5-yl)methyl]pyrimidine-2,4-dione diperchlorate Traditional Name: 1,3-bis[(4-amino-1,2-dimethyl-pyrimidin-1-ium-5-yl)methyl]pyrimidine-2,4-quinone diperchlorate Formula: C18H24Cl2N8O10 MolecularWeight: 583.33676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=N1)N)CN2C=CC(=O)N(C2=O)CC3=C[N+](=C(N=C3N)C)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=[N+](C=C(C(=N1)N)CN2C=CC(=O)N(C2=O)CC3=C[N+](=C(N=C3N)C)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H22N8O2.2ClHO4/c1-11-21-16(19)13(7-23(11)3)9-25-6-5-15(27)26(18(25)28)10-14-8-24(4)12(2)22-17(14)20;2*2-1(3,4)5/h5-8,19-20H,9-10H2,1-4H3;2*(H,2,3,4,5)