Chem
J-GLOBAL ID:200907029570841929   Nikkaji number:J2.455.441D

Bis(2-nitrobenzenesulfonic acid)2,4,5,7-tetrafluoro-3′-oxospiro[9H-xanthene-9,1′(3′H)-isobenzofuran]-3,6-diyl ester

ビス(2-ニトロベンゼンスルホン酸)2,4,5,7-テトラフルオロ-3′-オキソスピロ[9H-キサンテン-9,1′(3′H)-イソベンゾフラン]-3,6-ジイル
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: C32H14F4[N+]2O11[O-]2S2
Molecular formula furigana: C32-H14-F4-N2-O13-S2
Molecular weight: 774.580
InChI: InChI=1S/C32H14F4N2O13S2/c33-19-13-17-27(25(35)29(19)50-52(44,45)23-11-5-3-9-21(23)37(40)41)48-28-18(32(17)16-8-2-1-7-15(16)31(39)49-32)14-20(34)30(26(28)36)51-53(46,47)24-12-6-4-10-22(24)38(42)43/h1-14H
InChI key: PCAHBNBWKWWOJZ-UHFFFAOYSA-N
SMILES: [O-][N+](=O)c1ccccc1S(=O)(=O)Oc1c(F)cc2c(Oc3c(F)c(OS(=O)(=O)c4ccccc4[N+](=O)[O-])c(F)cc3C32OC(=O)c2ccccc32)c1F
Systematic name  (3):
  • ビス(2-ニトロベンゼンスルホン酸)2,4,5,7-テトラフルオロ-3′-オキソスピロ[9H-キサンテン-9,1′(3′H)-イソベンゾフラン]-3,6-ジイル
  • 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-スピロ[2-ベンゾフラン-1,9'-キサンテン]-3'-イル 2-ニトロベンゼン-1-スルホナート
  • 2',4',5',7'-tetrafluoro-6'-[(2-nitrobenzenesulfonyl)oxy]-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-3'-yl 2-nitrobenzene-1-sulfonate
Other name (1):
  • Bis(2-nitrobenzenesulfonic acid)2,4,5,7-tetrafluoro-3′-oxospiro[9H-xanthene-9,1′(3′H)-isobenzofuran]-3,6-diyl ester
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