Chem
J-GLOBAL ID：200907049436015401   Nikkaji number：J2.111.559B

2-[3,5-Dibromo-4-hydroxyphenyl(3,5-dibromo-4-oxo-2,5-cyclohexadienylidene)methyl]benzenesulfonic acid

2-[3,5-ジブロモ-4-ヒドロキシフェニル(3,5-ジブロモ-4-オキソ-2,5-シクロヘキサジエニリデン)メチル]ベンゼンスルホン酸
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： C19H10Br4O5S
Molecular formula furigana： C19-H10-BR4-O5-S
Molecular weight： 669.960
InChI： InChI=1S/C19H10Br4O5S/c20-12-5-9(6-13(21)18(12)24)17(10-7-14(22)19(25)15(23)8-10)11-3-1-2-4-16(11)29(26,27)28/h1-8,24H,(H,26,27,28)
InChI key： FKNLPHIFYDXHIC-UHFFFAOYSA-N
SMILES： Oc1c(Br)cc(cc1Br)/C(=C\1/C=C(Br)C(=O)C(=C1)Br)/c1ccccc1S(=O)(=O)O
Systematic name  (3)：
  • 2-[3,5-ジブロモ-4-ヒドロキシフェニル(3,5-ジブロモ-4-オキソ-2,5-シクロヘキサジエニリデン)メチル]ベンゼンスルホン酸
  • 2-[(3,5-ジブロモ-4-ヒドロキシフェニル)(3,5-ジブロモ-4-オキソシクロヘキサ-2,5-ジエン-1-イリデン)メチル]ベンゼン-1-スルホン酸
  • 2-[(3,5-dibromo-4-hydroxyphenyl)(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]benzene-1-sulfonic acid
Other name (1)：
  • 2-[3,5-Dibromo-4-hydroxyphenyl(3,5-dibromo-4-oxo-2,5-cyclohexadienylidene)methyl]benzenesulfonic acid
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