1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]-N-hexyl-pyridin-1-ium-4-amine dichloride

Systemtic Name: 1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]-N-hexyl-pyridin-1-ium-4-amine dichloride Openeye Name: 1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]-N-hexyl-pyridin-1-ium-4-amine dichloride CAS Name: 1-[9-[4-(heptylamino)-1-pyridin-1-iumyl]nonyl]-N-hexyl-4-pyridin-1-iumamine dichloride IUPAC Name: 1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]-N-hexylpyridin-1-ium-4-amine dichloride Traditional Name: heptyl-[1-[9-[4-(hexylamino)pyridin-1-ium-1-yl]nonyl]pyridin-1-ium-4-yl]amine dichloride Formula: C32H56Cl2N4 MolecularWeight: 567.71984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=CC=[N+](C=C1)CCCCCCCCC[N+]2=CC=C(C=C2)NCCCCCC.[Cl-].[Cl-]

Isomeric SMILES

CCCCCCCNC1=CC=[N+](C=C1)CCCCCCCCC[N+]2=CC=C(C=C2)NCCCCCC.[Cl-].[Cl-]

InChI

InChI=1S/C32H54N4.2ClH/c1-3-5-7-12-16-24-34-32-21-29-36(30-22-32)26-18-14-11-9-10-13-17-25-35-27-19-31(20-28-35)33-23-15-8-6-4-2;;/h19-22,27-30H,3-18,23-26H2,1-2H3;2*1H