N,N-dimethyl-1-(2-pyridin-1-ium-1-ylprop-2-enyl)pyridin-1-ium-4-amine diperchlorate

Systemtic Name: N,N-dimethyl-1-(2-pyridin-1-ium-1-ylprop-2-enyl)pyridin-1-ium-4-amine diperchlorate Openeye Name: N,N-dimethyl-1-(2-pyridin-1-ium-1-ylallyl)pyridin-1-ium-4-amine diperchlorate CAS Name: N,N-dimethyl-1-[2-(1-pyridin-1-iumyl)prop-2-enyl]-4-pyridin-1-iumamine diperchlorate IUPAC Name: N,N-dimethyl-1-(2-pyridin-1-ium-1-ylprop-2-enyl)pyridin-1-ium-4-amine diperchlorate Traditional Name: dimethyl-[1-(2-pyridin-1-ium-1-ylallyl)pyridin-1-ium-4-yl]amine diperchlorate Formula: C15H19Cl2N3O8 MolecularWeight: 440.23266

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=C)[N+]2=CC=CC=C2.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=C)[N+]2=CC=CC=C2.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C15H19N3.2ClHO4/c1-14(18-9-5-4-6-10-18)13-17-11-7-15(8-12-17)16(2)3;2*2-1(3,4)5/h4-12H,1,13H2,2-3H3;2*(H,2,3,4,5)/q+2;;/p-2