N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide

Systemtic Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide Openeye Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide CAS Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)-1-pyridin-1-iumyl]heptyl]-4-pyridin-1-iumamine dibromide IUPAC Name: N-(2-ethylhexyl)-1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide Traditional Name: 2-ethylhexyl-[1-[7-[4-(2-ethylhexylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-yl]amine dibromide Formula: C33H58Br2N4 MolecularWeight: 670.64842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC1=CC=[N+](C=C1)CCCCCCC[N+]2=CC=C(C=C2)NCC(CC)CCCC.[Br-].[Br-]

Isomeric SMILES

CCCCC(CC)CNC1=CC=[N+](C=C1)CCCCCCC[N+]2=CC=C(C=C2)NCC(CC)CCCC.[Br-].[Br-]

InChI

InChI=1S/C33H56N4.2BrH/c1-5-9-16-30(7-3)28-34-32-18-24-36(25-19-32)22-14-12-11-13-15-23-37-26-20-33(21-27-37)35-29-31(8-4)17-10-6-2;;/h18-21,24-27,30-31H,5-17,22-23,28-29H2,1-4H3;2*1H