1-[3,5-bis(2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium-1-yl)cyclohexyl]-2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium tribromide

Systemtic Name: 1-[3,5-bis(2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium-1-yl)cyclohexyl]-2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium tribromide Openeye Name: 1-[3,5-bis(2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium-1-yl)cyclohexyl]-2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium tribromide CAS Name: 1-[3,5-bis(2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium-1-yl)cyclohexyl]-2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium tribromide IUPAC Name: 1-[3,5-bis(2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium-1-yl)cyclohexyl]-2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium tribromide Traditional Name: 1-[3,5-bis(2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium-1-yl)cyclohexyl]-2,3-dihydroimidazo[1,2-f]phenanthridin-4-ium tribromide Formula: C51H45Br3N6 MolecularWeight: 981.6552

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2=C(N1C3CC(CC(C3)N4CC[N+]5=C4C6=CC=CC=C6C7=CC=CC=C75)N8CC[N+]9=C8C1=CC=CC=C1C1=CC=CC=C19)C1=CC=CC=C1C1=CC=CC=C12.[Br-].[Br-].[Br-]

Isomeric SMILES

C1C[N+]2=C(N1C3CC(CC(C3)N4CC[N+]5=C4C6=CC=CC=C6C7=CC=CC=C75)N8CC[N+]9=C8C1=CC=CC=C1C1=CC=CC=C19)C1=CC=CC=C1C1=CC=CC=C12.[Br-].[Br-].[Br-]

InChI

InChI=1S/C51H45N6.3BrH/c1-4-19-43-37(13-1)40-16-7-10-22-46(40)55-28-25-52(49(43)55)34-31-35(53-26-29-56-47-23-11-8-17-41(47)38-14-2-5-20-44(38)50(53)56)33-36(32-34)54-27-30-57-48-24-12-9-18-42(48)39-15-3-6-21-45(39)51(54)57;;;/h1-24,34-36H,25-33H2;3*1H/q+3;;;/p-3