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1-(anthracen-9-ylmethyl)-3-[2-[2-[2-[3-(anthracen-9-ylmethyl)imidazol-3-ium-1-yl]ethoxy]ethoxy]ethyl]imidazol-1-ium diiodide
1-(anthracen-9-ylmethyl)-3-[2-[2-[2-[3-(anthracen-9-ylmethyl)imidazol-3-ium-1-yl]ethoxy]ethoxy]ethyl]imidazol-1-ium diiodide
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C[N+]4=CN(C=C4)CCOCCOCCN5C=C[N+](=C5)CC6=C7C=CC=CC7=CC8=CC=CC=C86.[I-].[I-]
Isomeric SMILES
C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C[N+]4=CN(C=C4)CCOCCOCCN5C=C[N+](=C5)CC6=C7C=CC=CC7=CC8=CC=CC=C86.[I-].[I-]
InChI
InChI=1S/C42H40N4O2.2HI/c1-5-13-37-33(9-1)27-34-10-2-6-14-38(34)41(37)29-45-19-17-43(31-45)21-23-47-25-26-48-24-22-44-18-20-46(32-44)30-42-39-15-7-3-11-35(39)28-36-12-4-8-16-40(36)42;;/h1-20,27-28,31-32H,21-26,29-30H2;2*1H/q+2;;/p-2
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