Chem
J-GLOBAL ID：200907009749876244   Nikkaji number：J2.173.277J

2-[2,4,5,7-Tetrafluoro-6-(2-nitrophenylsulfonyloxy)-3-oxo-3H-xanthene-9-yl]benzoic acid

2-[2,4,5,7-テトラフルオロ-6-(2-ニトロフェニルスルホニルオキシ)-3-オキソ-3H-キサンテン-9-イル]安息香酸
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： C26H11F4[N+]O8[O-]S
Molecular formula furigana： C26-H11-F4-N-O9-S
Molecular weight： 589.430
InChI： InChI=1S/C26H11F4NO9S/c27-15-9-13-19(11-5-1-2-6-12(11)26(33)34)14-10-16(28)25(21(30)24(14)39-23(13)20(29)22(15)32)40-41(37,38)18-8-4-3-7-17(18)31(35)36/h1-10H,(H,33,34)
InChI key： MBCAHZJBAOIYKY-UHFFFAOYSA-N
SMILES： OC(=O)c1ccccc1c1c2cc(F)c(OS(=O)(=O)c3ccccc3[N+](=O)[O-])c(F)c2oc2c(F)c(=O)c(F)cc12
Systematic name  (4)：
  • 2-[2,4,5,7-テトラフルオロ-6-(2-ニトロフェニルスルホニルオキシ)-3-オキソ-3H-キサンテン-9-イル]安息香酸
  • 2-[2,4,5,7-テトラフルオロ-3-オキソ-6-[(2-ニトロフェニル)スルホニルオキシ]-3H-キサンテン-9-イル]安息香酸
  • 2-{2,4,5,7-テトラフルオロ-6-[(2-ニトロベンゼンスルホニル)オキシ]-3-オキソ-3H-キサンテン-9-イル}安息香酸
  • 2-{2,4,5,7-tetrafluoro-6-[(2-nitrobenzenesulfonyl)oxy]-3-oxo-3H-xanthen-9-yl}benzoic acid
Other name (2)：
  • 2-[2,4,5,7-Tetrafluoro-6-(2-nitrophenylsulfonyloxy)-3-oxo-3H-xanthene-9-yl]benzoic acid
  • 2-[2,4,5,7-Tetrafluoro-3-oxo-6-[(2-nitrophenyl)sulfonyloxy]-3H-xanthene-9-yl]benzoic acid
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