Chem
J-GLOBAL ID：200907033460272195   Nikkaji number：J2.239.279D

(6-Phenyl-2-oxo-3-cyano-2H-pyran-4-yl)malonic acid dimethyl ester

(6-フェニル-2-オキソ-3-シアノ-2H-ピラン-4-イル)マロン酸ジメチル
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： C17H13NO6
Molecular formula furigana： C17-H13-N-O6
Molecular weight： 327.292
InChI： InChI=1S/C17H13NO6/c1-22-16(20)14(17(21)23-2)11-8-13(10-6-4-3-5-7-10)24-15(19)12(11)9-18/h3-8,14H,1-2H3
InChI key： DLRKXYSJPVLCCK-UHFFFAOYSA-N
SMILES： COC(=O)C(C(=O)OC)c1cc(oc(=O)c1C#N)c1ccccc1
Systematic name  (4)：
  • 2-(2-オキソ-3-シアノ-6-フェニル-2H-ピラン-4-イル)マロン酸ジメチル
  • (6-フェニル-2-オキソ-3-シアノ-2H-ピラン-4-イル)マロン酸ジメチル
  • 1,3-ジメチル 2-(3-シアノ-2-オキソ-6-フェニル-2H-ピラン-4-イル)プロパンジオアート
  • 1,3-dimethyl 2-(3-cyano-2-oxo-6-phenyl-2H-pyran-4-yl)propanedioate
Other name (2)：
  • 2-(2-Oxo-3-cyano-6-phenyl-2H-pyran-4-yl)malonic acid dimethyl ester
  • (6-Phenyl-2-oxo-3-cyano-2H-pyran-4-yl)malonic acid dimethyl ester
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