1-methyl-4-(1-methylpyridin-1-ium-4-yl)-2,3-bis[(E)-2-phenylethenyl]pyridin-1-ium diperchlorate

Systemtic Name: 1-methyl-4-(1-methylpyridin-1-ium-4-yl)-2,3-bis[(E)-2-phenylethenyl]pyridin-1-ium diperchlorate Openeye Name: 1-methyl-4-(1-methylpyridin-1-ium-4-yl)-2,3-bis[(E)-styryl]pyridin-1-ium diperchlorate CAS Name: 1-methyl-4-(1-methyl-4-pyridin-1-iumyl)-2,3-bis[(E)-2-phenylethenyl]pyridin-1-ium diperchlorate IUPAC Name: 1-methyl-4-(1-methylpyridin-1-ium-4-yl)-2,3-bis[(E)-2-phenylethenyl]pyridin-1-ium diperchlorate Traditional Name: 1-methyl-4-(1-methylpyridin-1-ium-4-yl)-2,3-bis[(E)-styryl]pyridin-1-ium diperchlorate Formula: C28H26Cl2N2O8 MolecularWeight: 589.42064

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2=C(C(=[N+](C=C2)C)C=CC3=CC=CC=C3)C=CC4=CC=CC=C4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2=C(C(=[N+](C=C2)C)/C=C/C3=CC=CC=C3)/C=C/C4=CC=CC=C4.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C28H26N2.2ClHO4/c1-29-20-17-25(18-21-29)26-19-22-30(2)28(16-14-24-11-7-4-8-12-24)27(26)15-13-23-9-5-3-6-10-23;2*2-1(3,4)5/h3-22H,1-2H3;2*(H,2,3,4,5)/q+2;;/p-2/b15-13+,16-14+;;