Chem
J-GLOBAL ID：200907080039748278   Nikkaji number：J1.124.220K

2,4,6-Trimethylbenzenesulfonic acid 3-oxo-1,2-benziodoxole-1(3H)-yl ester

2,4,6-トリメチルベンゼンスルホン酸3-オキソ-1,2-ベンゾヨードキソール-1(3H)-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： C16H15IO5S
Molecular formula furigana： C16-H15-I-O5-S
Molecular weight： 446.260
InChI： InChI=1S/C16H15IO5S/c1-10-8-11(2)15(12(3)9-10)23(19,20)22-17-14-7-5-4-6-13(14)16(18)21-17/h4-9H,1-3H3
InChI key： WEYJHZHBXDENJJ-UHFFFAOYSA-N
SMILES： Cc1cc(C)c(c(C)c1)S(=O)(=O)O[I]1OC(=O)c2ccccc12
Systematic name  (3)：
  • 2,4,6-トリメチルベンゼンスルホン酸3-オキソ-1,2-ベンゾヨードキソール-1(3H)-イル
  • 3-オキソ-3H-1λ3,2-ベンゾヨーダオキソール-1-イル 2,4,6-トリメチルベンゼン-1-スルホナート
  • 3-oxo-3H-1λ3,2-benziodaoxol-1-yl 2,4,6-trimethylbenzene-1-sulfonate
Other name (1)：
  • 2,4,6-Trimethylbenzenesulfonic acid 3-oxo-1,2-benziodoxole-1(3H)-yl ester
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