Chem
J-GLOBAL ID:200907045582700803   Nikkaji number:J1.867.746F

1,1′-(Trimethylene)bis[4-[4-(hexadecylsulfonyl)styryl]pyridinium]

1,1′-(トリメチレン)ビス[4-[4-(ヘキサデシルスルホニル)スチリル]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: C61H92[N+]2O4S2
Molecular formula furigana: C61-H92-N2-O4-S2
Molecular weight: 981.540
InChI: InChI=1S/C61H92N2O4S2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-54-68(64,65)60-40-36-56(37-41-60)32-34-58-44-50-62(51-45-58)48-31-49-63-52-46-59(47-53-63)35-33-57-38-42-61(43-39-57)69(66,67)55-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-47,50-53H,3-31,48-49,54-55H2,1-2H3/q+2
InChI key: MZSPQFYDCBMFDF-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCCS(=O)(=O)c1ccc(C=Cc2cc[n+](CCC[n+]3ccc(C=Cc4ccc(cc4)S(=O)(=O)CCCCCCCCCCCCCCCC)cc3)cc2)cc1
Systematic name  (4):
  • 1,1′-(1,3-プロパンジイル)ビス[4-[2-[4-(ヘキサデシルスルホニル)フェニル]エテニル]ピリジニウム]
  • 1,1′-(トリメチレン)ビス[4-[4-(ヘキサデシルスルホニル)スチリル]ピリジニウム]
  • 4-{2-[4-(ヘキサデカン-1-スルホニル)フェニル]エテニル}-1-[3-(4-{2-[4-(ヘキサデカン-1-スルホニル)フェニル]エテニル}ピリジン-1-イウム-1-イル)プロピル]ピリジン-1-イウム
  • 4-{2-[4-(hexadecane-1-sulfonyl)phenyl]ethenyl}-1-[3-(4-{2-[4-(hexadecane-1-sulfonyl)phenyl]ethenyl}pyridin-1-ium-1-yl)propyl]pyridin-1-ium
Other name (2):
  • 1,1′-(1,3-Propanediyl)bis[4-[2-[4-(hexadecylsulfonyl)phenyl]ethenyl]pyridinium]
  • 1,1′-(Trimethylene)bis[4-[4-(hexadecylsulfonyl)styryl]pyridinium]
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