Chem
J-GLOBAL ID：200907001385187730   Nikkaji number：J336.004K

3β-Cyano-2α-(diphenylphosphinyl)-5α-phenyl-4α-(methoxycarbonyl)-2-pyrrolidinecarboxylic acid benzyl ester

3β-シアノ-2α-(ジフェニルホスフィニル)-5α-フェニル-4α-(メトキシカルボニル)-2-ピロリジンカルボン酸ベンジル
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： C33H29N2O5P
Molecular formula furigana： C33-H29-N2-O5-P
Molecular weight： 564.578
InChI： InChI=1S/C33H29N2O5P/c1-39-31(36)29-28(22-34)33(35-30(29)25-16-8-3-9-17-25,32(37)40-23-24-14-6-2-7-15-24)41(38,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-21,28-30,35H,23H2,1H3/t28-,29-,30-,33-/m0/s1
InChI key： WDDHKTINAIVZMJ-ZGDGUDBWSA-N
SMILES： COC(=O)[C@@H]1[C@@H](N[C@]([C@H]1C#N)(C(=O)OCc1ccccc1)P(=O)(c1ccccc1)c1ccccc1)c1ccccc1
Systematic name  (3)：
  • 3β-シアノ-2α-(ジフェニルホスフィニル)-5α-フェニル-4α-(メトキシカルボニル)-2-ピロリジンカルボン酸ベンジル
  • 2-ベンジル 4-メチル (2S,3R,4S,5R)-3-シアノ-2-(ジフェニルホスホロソ)-5-フェニルピロリジン-2,4-ジカルボキシラート
  • 2-benzyl 4-methyl (2S,3R,4S,5R)-3-cyano-2-(diphenylphosphoroso)-5-phenylpyrrolidine-2,4-dicarboxylate
Other name (1)：
  • 3β-Cyano-2α-(diphenylphosphinyl)-5α-phenyl-4α-(methoxycarbonyl)-2-pyrrolidinecarboxylic acid benzyl ester
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