2,4,6-triphenyl-1-[3-(2,4,6-triphenylpyridin-1-ium-1-yl)phenyl]pyridin-1-ium diiodide

Systemtic Name: 2,4,6-triphenyl-1-[3-(2,4,6-triphenylpyridin-1-ium-1-yl)phenyl]pyridin-1-ium diiodide Openeye Name: 2,4,6-triphenyl-1-[3-(2,4,6-triphenylpyridin-1-ium-1-yl)phenyl]pyridin-1-ium diiodide CAS Name: 2,4,6-triphenyl-1-[3-(2,4,6-triphenyl-1-pyridin-1-iumyl)phenyl]pyridin-1-ium diiodide IUPAC Name: 2,4,6-triphenyl-1-[3-(2,4,6-triphenylpyridin-1-ium-1-yl)phenyl]pyridin-1-ium diiodide Traditional Name: 2,4,6-triphenyl-1-[3-(2,4,6-triphenylpyridin-1-ium-1-yl)phenyl]pyridin-1-ium diiodide Formula: C52H38I2N2 MolecularWeight: 944.68046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C4=CC(=CC=C4)[N+]5=C(C=C(C=C5C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9.[I-].[I-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=[N+](C(=C2)C3=CC=CC=C3)C4=CC(=CC=C4)[N+]5=C(C=C(C=C5C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C9=CC=CC=C9.[I-].[I-]

InChI

InChI=1S/C52H38N2.2HI/c1-7-20-39(21-8-1)45-34-49(41-24-11-3-12-25-41)53(50(35-45)42-26-13-4-14-27-42)47-32-19-33-48(38-47)54-51(43-28-15-5-16-29-43)36-46(40-22-9-2-10-23-40)37-52(54)44-30-17-6-18-31-44;;/h1-38H;2*1H/q+2;;/p-2