N-dodecyl-1-[10-[4-(dodecylamino)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-amine dibromide

Systemtic Name: N-dodecyl-1-[10-[4-(dodecylamino)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-amine dibromide Openeye Name: N-dodecyl-1-[10-[4-(dodecylamino)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-amine dibromide CAS Name: N-dodecyl-1-[10-[4-(dodecylamino)-1-pyridin-1-iumyl]decyl]-4-pyridin-1-iumamine dibromide IUPAC Name: N-dodecyl-1-[10-[4-(dodecylamino)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-amine dibromide Traditional Name: lauryl-[1-[10-[4-(laurylamino)pyridin-1-ium-1-yl]decyl]pyridin-1-ium-4-yl]amine dibromide Formula: C44H80Br2N4 MolecularWeight: 824.9408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC1=CC=[N+](C=C1)CCCCCCCCCC[N+]2=CC=C(C=C2)NCCCCCCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCCCCNC1=CC=[N+](C=C1)CCCCCCCCCC[N+]2=CC=C(C=C2)NCCCCCCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C44H78N4.2BrH/c1-3-5-7-9-11-13-15-19-23-27-35-45-43-31-39-47(40-32-43)37-29-25-21-17-18-22-26-30-38-48-41-33-44(34-42-48)46-36-28-24-20-16-14-12-10-8-6-4-2;;/h31-34,39-42H,3-30,35-38H2,1-2H3;2*1H