zinc 1-(6-pyridin-2-ylpyridin-2-yl)-1,4,7,10-tetrazacyclododecane diperchlorate

Systemtic Name: zinc 1-(6-pyridin-2-ylpyridin-2-yl)-1,4,7,10-tetrazacyclododecane diperchlorate Openeye Name: zinc 1-[6-(2-pyridyl)-2-pyridyl]-1,4,7,10-tetrazacyclododecane diperchlorate CAS Name: zinc 1-[6-(2-pyridinyl)-2-pyridinyl]-1,4,7,10-tetrazacyclododecane diperchlorate IUPAC Name: zinc 1-(6-pyridin-2-ylpyridin-2-yl)-1,4,7,10-tetrazacyclododecane diperchlorate Traditional Name: zinc 1-[6-(2-pyridyl)-2-pyridyl]-1,4,7,10-tetrazacyclododecane diperchlorate Formula: C18H26Cl2N6O8Zn MolecularWeight: 590.74944

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(CCNCCN1)C2=CC=CC(=N2)C3=CC=CC=N3.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Zn+2]

Isomeric SMILES

C1CNCCN(CCNCCN1)C2=CC=CC(=N2)C3=CC=CC=N3.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Zn+2]

InChI

InChI=1S/C18H26N6.2ClHO4.Zn/c1-2-7-22-16(4-1)17-5-3-6-18(23-17)24-14-12-20-10-8-19-9-11-21-13-15-24;2*2-1(3,4)5;/h1-7,19-21H,8-15H2;2*(H,2,3,4,5);/q;;;+2/p-2