Chem
J-GLOBAL ID：201807018682378324   Nikkaji number：J3.721.376D

4,4′-[(Pyrene-1,6-diyl)bisvinylene]bis(1-methylpyridinium)

4,4′-[(ピレン-1,6-ジイル)ビスビニレン]ビス(1-メチルピリジニウム)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C32H26[N+]2
Molecular formula furigana： C32-H26-N2
Molecular weight： 438.573
InChI： InChI=1S/C32H26N2/c1-33-19-15-23(16-20-33)3-5-25-7-9-27-12-14-30-26(6-4-24-17-21-34(2)22-18-24)8-10-28-11-13-29(25)31(27)32(28)30/h3-22H,1-2H3/q+2
InChI key： XZIATSYYNAIDCX-UHFFFAOYSA-N
SMILES： C[n+]1ccc(C=Cc2ccc3ccc4c(C=Cc5cc[n+](C)cc5)ccc5ccc2c3c45)cc1
Systematic name  (3)：
  • 4,4′-[(ピレン-1,6-ジイル)ビスビニレン]ビス(1-メチルピリジニウム)
  • 1-メチル-4-(2-{6-[2-(1-メチルピリジン-1-イウム-4-イル)エテニル]ピレン-1-イル}エテニル)ピリジン-1-イウム
  • 1-methyl-4-(2-{6-[2-(1-methylpyridin-1-ium-4-yl)ethenyl]pyren-1-yl}ethenyl)pyridin-1-ium
Other name (1)：
  • 4,4′-[(Pyrene-1,6-diyl)bisvinylene]bis(1-methylpyridinium)
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