N-octyl-1-[14-[4-(octylamino)pyridin-1-ium-1-yl]tetradecyl]pyridin-1-ium-4-amine dibromide

Systemtic Name: N-octyl-1-[14-[4-(octylamino)pyridin-1-ium-1-yl]tetradecyl]pyridin-1-ium-4-amine dibromide Openeye Name: N-octyl-1-[14-[4-(octylamino)pyridin-1-ium-1-yl]tetradecyl]pyridin-1-ium-4-amine dibromide CAS Name: N-octyl-1-[14-[4-(octylamino)-1-pyridin-1-iumyl]tetradecyl]-4-pyridin-1-iumamine dibromide IUPAC Name: N-octyl-1-[14-[4-(octylamino)pyridin-1-ium-1-yl]tetradecyl]pyridin-1-ium-4-amine dibromide Traditional Name: octyl-[1-[14-[4-(octylamino)pyridin-1-ium-1-yl]tetradecyl]pyridin-1-ium-4-yl]amine dibromide Formula: C40H72Br2N4 MolecularWeight: 768.83448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC=[N+](C=C1)CCCCCCCCCCCCCC[N+]2=CC=C(C=C2)NCCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCNC1=CC=[N+](C=C1)CCCCCCCCCCCCCC[N+]2=CC=C(C=C2)NCCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C40H70N4.2BrH/c1-3-5-7-9-19-23-31-41-39-27-35-43(36-28-39)33-25-21-17-15-13-11-12-14-16-18-22-26-34-44-37-29-40(30-38-44)42-32-24-20-10-8-6-4-2;;/h27-30,35-38H,3-26,31-34H2,1-2H3;2*1H