Chem
J-GLOBAL ID：200907080232114480   Nikkaji number：J2.134.839B

2′,4′,5′,7′-Tetrafluoro-3′,6′-bis(2,4-dinitrophenylsulfonyloxy)spiro[isobenzofuran-1(3H),9′-[9H]xanthene]-3-one

ビス(2,4-ジ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： C32H12F4[N+]4O13[O-]4S2
Molecular formula furigana： C32-H12-F4-N4-O17-S2
Molecular weight： 864.570
InChI： InChI=1S/C32H12F4N4O17S2/c33-19-11-17-27(25(35)29(19)56-58(50,51)23-7-5-13(37(42)43)9-21(23)39(46)47)54-28-18(32(17)16-4-2-1-3-15(16)31(41)55-32)12-20(34)30(26(28)36)57-59(52,53)24-8-6-14(38(44)45)10-22(24)40(48)49/h1-12H
InChI key： DFNMTYRNYDZAJM-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])S(=O)(=O)Oc1c(F)cc2c(Oc3c(F)c(OS(=O)(=O)c4ccc(cc4[N+](=O)[O-])[N+](=O)[O-])c(F)cc3C32OC(=O)c2ccccc32)c1F
Systematic name  (4)：
  • 2′,4′,5′,7′-テトラフルオロ-3′,6′-ビス(2,4-ジニトロフェニルスルホニルオキシ)スピロ[イソベンゾフラン-1(3H),9′-[9H]キサンテン]-3-オン
  • ビス(2,4-ジ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
  • 6'-[(2,4-ジニトロベンゼンスルホニル)オキシ]-2',4',5',7'-テトラフルオロ-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 2,4-ジニトロベンゼン-1-スルホナート
  • 6'-[(2,4-dinitrobenzenesulfonyl)oxy]-2',4',5',7'-tetrafluoro-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthen]-3'-yl 2,4-dinitrobenzene-1-sulfonate
Other name (2)：
  • 2′,4′,5′,7′-Tetrafluoro-3′,6′-bis(2,4-dinitrophenylsulfonyloxy)spiro[isobenzofuran-1(3H),9′-[9H]xanthene]-3-one
  • Bis(2,4-dinitrobenzenesulfonic acid)2,4,5,7-tetrafluoro-3′-oxospiro[9H-xanthene-9,1′(3′H)-isobenzofuran]-3,6-diyl ester
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