Chem
J-GLOBAL ID：200907035178242430   Nikkaji number：J2.654.196D

1-[(S)-1-Phenyl-2-nitroethyl]-2-oxocyclopentane-1α-carboxylic acid methyl ester

1-[(S)-1-フェニル-2-ニトロエチル]-2-オキソシクロペンタン-1α-カルボン酸メチル
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： C15H17[N+]O4[O-]
Molecular formula furigana： C15-H17-N-O5
Molecular weight： 291.303
InChI： InChI=1S/C15H17NO5/c1-21-14(18)15(9-5-8-13(15)17)12(10-16(19)20)11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3/t12-,15+/m0/s1
InChI key： PXQWCBKEMHAYSE-SWLSCSKDSA-N
SMILES： COC(=O)[C@]1(CCCC1=O)[C@@H](C[N+](=O)[O-])c1ccccc1
Systematic name  (9)：
  • (1R)-1-[(S)-α-(ニトロメチル)ベンジル]-2-オキソシクロペンタン-1α-カルボン酸メチル
  • 1-[(S)-1-フェニル-2-ニトロエチル]-2-オキソシクロペンタン-1α-カルボン酸メチル
  • (1R)-1-[(S)-2-ニトロ-1-フェニルエチル]-2-オキソシクロペンタン-1α-カルボン酸メチル
  • (R)-1-[(S)-α-(ニトロメチル)ベンジル]-2-オキソシクロペンタン-1α-カルボン酸メチル
  • (2R)-1-オキソ-2-((αS)-α-(ニトロメチル)ベンジル)シクロペンタン-2β-カルボン酸メチル
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Other name (7)：
  • (1R)-1-[(S)-α-(Nitromethyl)benzyl]-2-oxocyclopentane-1α-carboxylic acid methyl ester
  • 1-[(S)-1-Phenyl-2-nitroethyl]-2-oxocyclopentane-1α-carboxylic acid methyl ester
  • (1R)-1-[(S)-2-Nitro-1-phenylethyl]-2-oxocyclopentane-1α-carboxylic acid methyl ester
  • (R)-1-[(S)-α-(Nitromethyl)benzyl]-2-oxocyclopentane-1α-carboxylic acid methyl ester
  • (2R)-1-Oxo-2-((αS)-α-(nitromethyl)benzyl)cyclopentane-2β-carboxylic acid methyl ester
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