N-heptyl-1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]pyridin-1-ium-4-amine dibromide

Systemtic Name: N-heptyl-1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]pyridin-1-ium-4-amine dibromide Openeye Name: N-heptyl-1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]pyridin-1-ium-4-amine dibromide CAS Name: N-heptyl-1-[9-[4-(heptylamino)-1-pyridin-1-iumyl]nonyl]-4-pyridin-1-iumamine dibromide IUPAC Name: N-heptyl-1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]pyridin-1-ium-4-amine dibromide Traditional Name: heptyl-[1-[9-[4-(heptylamino)pyridin-1-ium-1-yl]nonyl]pyridin-1-ium-4-yl]amine dibromide Formula: C33H58Br2N4 MolecularWeight: 670.64842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H56N4.2BrH/c1-3-5-7-12-16-24-34-32-20-28-36(29-21-32)26-18-14-10-9-11-15-19-27-37-30-22-33(23-31-37)35-25-17-13-8-6-4-2;;/h20-23,28-31H,3-19,24-27H2,1-2H3;2*1H