6-[10-(12-azanylbenzo[i]phenanthridin-6-ium-6-yl)decyl]benzo[i]phenanthridin-6-ium-12-amine dibromide

Systemtic Name: 6-[10-(12-azanylbenzo[i]phenanthridin-6-ium-6-yl)decyl]benzo[i]phenanthridin-6-ium-12-amine dibromide Openeye Name: 6-[10-(12-aminobenzo[i]phenanthridin-6-ium-6-yl)decyl]benzo[i]phenanthridin-6-ium-12-amine dibromide CAS Name: 6-[10-(12-amino-6-benzo[i]phenanthridin-6-iumyl)decyl]-12-benzo[i]phenanthridin-6-iumamine dibromide IUPAC Name: 6-[10-(12-aminobenzo[i]phenanthridin-6-ium-6-yl)decyl]benzo[i]phenanthridin-6-ium-12-amine dibromide Traditional Name: [6-[10-(12-aminobenzo[i]phenanthridin-6-ium-6-yl)decyl]benzo[i]phenanthridin-6-ium-12-yl]amine dibromide Formula: C44H44Br2N4 MolecularWeight: 788.65496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC3=C2C=[N+](C4=CC=CC=C43)CCCCCCCCCC[N+]5=CC6=C(C=C(C7=CC=CC=C76)N)C8=CC=CC=C85)N.[Br-].[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC3=C2C=[N+](C4=CC=CC=C43)CCCCCCCCCC[N+]5=CC6=C(C=C(C7=CC=CC=C76)N)C8=CC=CC=C85)N.[Br-].[Br-]

InChI

InChI=1S/C44H42N4.2BrH/c45-41-27-37-35-21-11-13-23-43(35)47(29-39(37)31-17-7-9-19-33(31)41)25-15-5-3-1-2-4-6-16-26-48-30-40-32-18-8-10-20-34(32)42(46)28-38(40)36-22-12-14-24-44(36)48;;/h7-14,17-24,27-30,45-46H,1-6,15-16,25-26H2;2*1H