Chem
J-GLOBAL ID：200907062233265395   Nikkaji number：J835.493F

Esuprone

エスプロン
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： C13H14O5S
Molecular formula furigana： C13-H14-O5-S
Molecular weight： 282.310
InChI： InChI=1S/C13H14O5S/c1-4-19(15,16)18-10-5-6-11-8(2)9(3)13(14)17-12(11)7-10/h5-7H,4H2,1-3H3
InChI key： CHDGAVDQRSPBTA-UHFFFAOYSA-N
SMILES： CCS(=O)(=O)Oc1ccc2c(C)c(C)c(=O)oc2c1
Systematic name  (3)：
  • エタンスルホン酸3,4-ジメチル-2-オキソ-2H-1-ベンゾピラン-7-イル
  • 3,4-ジメチル-2-オキソ-2H-クロメン-7-イル エタン-1-スルホナート
  • 3,4-dimethyl-2-oxo-2H-chromen-7-yl ethane-1-sulfonate
Other name (4)：
  • エスプロン
  • Esuprone
  • Ethanesulfonic acid 3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl ester
  • LU-43839
CAS registry number： 91406-11-0
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