N-hexyl-1-[8-[4-(hexylamino)pyridin-1-ium-1-yl]octyl]pyridin-1-ium-4-amine dibromide

Systemtic Name: N-hexyl-1-[8-[4-(hexylamino)pyridin-1-ium-1-yl]octyl]pyridin-1-ium-4-amine dibromide Openeye Name: N-hexyl-1-[8-[4-(hexylamino)pyridin-1-ium-1-yl]octyl]pyridin-1-ium-4-amine dibromide CAS Name: N-hexyl-1-[8-[4-(hexylamino)-1-pyridin-1-iumyl]octyl]-4-pyridin-1-iumamine dibromide IUPAC Name: N-hexyl-1-[8-[4-(hexylamino)pyridin-1-ium-1-yl]octyl]pyridin-1-ium-4-amine dibromide Traditional Name: hexyl-[1-[8-[4-(hexylamino)pyridin-1-ium-1-yl]octyl]pyridin-1-ium-4-yl]amine dibromide Formula: C30H52Br2N4 MolecularWeight: 628.56868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=CC=[N+](C=C1)CCCCCCCC[N+]2=CC=C(C=C2)NCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCNC1=CC=[N+](C=C1)CCCCCCCC[N+]2=CC=C(C=C2)NCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C30H50N4.2BrH/c1-3-5-7-13-21-31-29-17-25-33(26-18-29)23-15-11-9-10-12-16-24-34-27-19-30(20-28-34)32-22-14-8-6-4-2;;/h17-20,25-28H,3-16,21-24H2,1-2H3;2*1H