9-[11-[4-[1-(11-acridin-9-ylundecyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]undecyl]acridine dibromide

Systemtic Name: 9-[11-[4-[1-(11-acridin-9-ylundecyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]undecyl]acridine dibromide Openeye Name: 9-[11-[4-[1-(11-acridin-9-ylundecyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]undecyl]acridine dibromide CAS Name: 9-[11-[4-[1-[11-(9-acridinyl)undecyl]-4-pyridin-1-iumyl]-1-pyridin-1-iumyl]undecyl]acridine dibromide IUPAC Name: 9-[11-[4-[1-(11-acridin-9-ylundecyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]undecyl]acridine dibromide Traditional Name: 9-[11-[4-[1-(11-acridin-9-ylundecyl)pyridin-1-ium-4-yl]pyridin-1-ium-1-yl]undecyl]acridine dibromide Formula: C58H68Br2N4 MolecularWeight: 980.99532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)CCCCCCCCCCC[N+]4=CC=C(C=C4)C5=CC=[N+](C=C5)CCCCCCCCCCCC6=C7C=CC=CC7=NC8=CC=CC=C86.[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)CCCCCCCCCCC[N+]4=CC=C(C=C4)C5=CC=[N+](C=C5)CCCCCCCCCCCC6=C7C=CC=CC7=NC8=CC=CC=C86.[Br-].[Br-]

InChI

InChI=1S/C58H68N4.2BrH/c1(3-7-11-15-27-49-51-29-17-21-33-55(51)59-56-34-22-18-30-52(49)56)5-9-13-25-41-61-43-37-47(38-44-61)48-39-45-62(46-40-48)42-26-14-10-6-2-4-8-12-16-28-50-53-31-19-23-35-57(53)60-58-36-24-20-32-54(50)58;;/h17-24,29-40,43-46H,1-16,25-28,41-42H2;2*1H/q+2;;/p-2