Chem
J-GLOBAL ID：200907021961391625   Nikkaji number：J867.369A

2-(4,5-Dibromo-2,7-dinitro-3-oxo-6-hydroxy-3H-xanthen-9-yl)benzoic acid

2-(2,7-ジニトロ-4,5-ジブロモ-6-ヒドロキシ-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： C20H8Br2[N+]2O7[O-]2
Molecular formula furigana： C20-H8-BR2-N2-O9
Molecular weight： 580.097
InChI： InChI=1S/C20H8Br2N2O9/c21-14-16(25)11(23(29)30)5-9-13(7-3-1-2-4-8(7)20(27)28)10-6-12(24(31)32)17(26)15(22)19(10)33-18(9)14/h1-6,25H,(H,27,28)
InChI key： YDIYPOHFEIEJPE-UHFFFAOYSA-N
SMILES： OC(=O)c1ccccc1c1c2cc(c(O)c(Br)c2oc2c(Br)c(=O)c(cc12)[N+](=O)[O-])[N+](=O)[O-]
Systematic name  (4)：
  • 2-(4,5-ジブロモ-2,7-ジニトロ-3-オキソ-6-ヒドロキシ-3H-キサンテン-9-イル)安息香酸
  • 2-(2,7-ジニトロ-4,5-ジブロモ-6-ヒドロキシ-3-オキソ-3H-キサンテン-9-イル)安息香酸
  • 2-(4,5-ジブロモ-6-ヒドロキシ-2,7-ジニトロ-3-オキソ-3H-キサンテン-9-イル)安息香酸
  • 2-(4,5-dibromo-6-hydroxy-2,7-dinitro-3-oxo-3H-xanthen-9-yl)benzoic acid
Other name (2)：
  • 2-(4,5-Dibromo-2,7-dinitro-3-oxo-6-hydroxy-3H-xanthen-9-yl)benzoic acid
  • 2-(2,7-Dinitro-4,5-dibromo-6-hydroxy-3-oxo-3H-xanthene-9-yl)benzoic acid
Thsaurus map：
Thesaurus Map

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