Chem
J-GLOBAL ID：200907016836000882   Nikkaji number：J2.092.707K

[(R)-1-Phenyl-2-nitroethyl]malonic acid dimethyl ester

[(R)-1-フェニル-2-ニトロエチル]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： C13H15[N+]O5[O-]
Molecular formula furigana： C13-H15-N-O6
Molecular weight： 281.264
InChI： InChI=1S/C13H15NO6/c1-19-12(15)11(13(16)20-2)10(8-14(17)18)9-6-4-3-5-7-9/h3-7,10-11H,8H2,1-2H3/t10-/m0/s1
InChI key： IBGOYXMLFPKRDY-JTQLQIEISA-N
SMILES： COC(=O)C([C@@H](C[N+](=O)[O-])c1ccccc1)C(=O)OC
Systematic name  (9)：
  • 2-[(R)-α-(ニトロメチル)ベンジル]マロン酸ジメチル
  • [(R)-1-フェニル-2-ニトロエチル]マロン酸ジメチル
  • 2-[(αR)-α-(ニトロメチル)ベンジル]マロン酸ジメチル
  • 2-[(1R)-1-フェニル-2-ニトロエチル]マロン酸ジメチル
  • 2-[(R)-1-フェニル-2-ニトロエチル]マロン酸ジメチル
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Other name (7)：
  • 2-[(R)-α-(Nitromethyl)benzyl]malonic acid dimethyl ester
  • [(R)-1-Phenyl-2-nitroethyl]malonic acid dimethyl ester
  • 2-[(αR)-α-(Nitromethyl)benzyl]malonic acid dimethyl ester
  • 2-[(1R)-1-Phenyl-2-nitroethyl]malonic acid dimethyl ester
  • 2-[(R)-1-Phenyl-2-nitroethyl]malonic acid dimethyl ester
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