1-methyl-4-[4-(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)butyl]-2,6-diphenyl-pyridin-1-ium diperchlorate

Systemtic Name: 1-methyl-4-[4-(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)butyl]-2,6-diphenyl-pyridin-1-ium diperchlorate Openeye Name: 1-methyl-4-[4-(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)butyl]-2,6-diphenyl-pyridin-1-ium diperchlorate CAS Name: 1-methyl-4-[4-(1-methyl-2,6-diphenyl-4-pyridin-1-iumyl)butyl]-2,6-diphenylpyridin-1-ium diperchlorate IUPAC Name: 1-methyl-4-[4-(1-methyl-2,6-diphenylpyridin-1-ium-4-yl)butyl]-2,6-diphenylpyridin-1-ium diperchlorate Traditional Name: 1-methyl-4-[4-(1-methyl-2,6-diphenyl-pyridin-1-ium-4-yl)butyl]-2,6-diphenyl-pyridin-1-ium diperchlorate Formula: C40H38Cl2N2O8 MolecularWeight: 745.64432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=C(C=C1C2=CC=CC=C2)CCCCC3=CC(=[N+](C(=C3)C4=CC=CC=C4)C)C5=CC=CC=C5)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=C(C=C(C=C1C2=CC=CC=C2)CCCCC3=CC(=[N+](C(=C3)C4=CC=CC=C4)C)C5=CC=CC=C5)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C40H38N2.2ClHO4/c1-41-37(33-19-7-3-8-20-33)27-31(28-38(41)34-21-9-4-10-22-34)17-15-16-18-32-29-39(35-23-11-5-12-24-35)42(2)40(30-32)36-25-13-6-14-26-36;2*2-1(3,4)5/h3-14,19-30H,15-18H2,1-2H3;2*(H,2,3,4,5)/q+2;;/p-2