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6-(8-benzo[i]phenanthridin-6-ium-6-yloctyl)benzo[i]phenanthridin-6-ium dibromide
6-(8-benzo[i]phenanthridin-6-ium-6-yloctyl)benzo[i]phenanthridin-6-ium dibromide
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C2C(=C1)C=CC3=C2C=[N+](C4=CC=CC=C34)CCCCCCCC[N+]5=CC6=C(C=CC7=CC=CC=C76)C8=CC=CC=C85.[Br-].[Br-]
Isomeric SMILES
C1=CC=C2C(=C1)C=CC3=C2C=[N+](C4=CC=CC=C34)CCCCCCCC[N+]5=CC6=C(C=CC7=CC=CC=C76)C8=CC=CC=C85.[Br-].[Br-]
InChI
InChI=1S/C42H38N2.2BrH/c1(3-13-27-43-29-39-33-17-7-5-15-31(33)23-25-35(39)37-19-9-11-21-41(37)43)2-4-14-28-44-30-40-34-18-8-6-16-32(34)24-26-36(40)38-20-10-12-22-42(38)44;;/h5-12,15-26,29-30H,1-4,13-14,27-28H2;2*1H/q+2;;/p-2
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