N-decyl-1-[7-[4-(decylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide

Systemtic Name: N-decyl-1-[7-[4-(decylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide Openeye Name: N-decyl-1-[7-[4-(decylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide CAS Name: N-decyl-1-[7-[4-(decylamino)-1-pyridin-1-iumyl]heptyl]-4-pyridin-1-iumamine dibromide IUPAC Name: N-decyl-1-[7-[4-(decylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-amine dibromide Traditional Name: decyl-[1-[7-[4-(decylamino)pyridin-1-ium-1-yl]heptyl]pyridin-1-ium-4-yl]amine dibromide Formula: C37H66Br2N4 MolecularWeight: 726.75474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=CC=[N+](C=C1)CCCCCCC[N+]2=CC=C(C=C2)NCCCCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCCNC1=CC=[N+](C=C1)CCCCCCC[N+]2=CC=C(C=C2)NCCCCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C37H64N4.2BrH/c1-3-5-7-9-11-13-16-20-28-38-36-24-32-40(33-25-36)30-22-18-15-19-23-31-41-34-26-37(27-35-41)39-29-21-17-14-12-10-8-6-4-2;;/h24-27,32-35H,3-23,28-31H2,1-2H3;2*1H