Chem
J-GLOBAL ID：201607016309418467   Nikkaji number：J3.462.338D

3-(3,4-Dimethoxyphenyl)-3α-(3-oxobutyl)-2-oxopyrrolidine-1-carboxylic acid tert-butyl ester

3-(3,4-ジメトキシフェニル)-3α-(3-オキソブチル)-2-オキソピロリジン-1-カルボン酸tert-ブチル
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： C21H29NO6
Molecular formula furigana： C21-H29-N-O6
Molecular weight： 391.464
InChI： InChI=1S/C21H29NO6/c1-14(23)9-10-21(15-7-8-16(26-5)17(13-15)27-6)11-12-22(18(21)24)19(25)28-20(2,3)4/h7-8,13H,9-12H2,1-6H3/t21-/m1/s1
InChI key： MDVDWMFSCCDMHX-OAQYLSRUSA-N
SMILES： COc1ccc(cc1OC)[C@@]1(CCC(=O)C)CCN(C(=O)OC(C)(C)C)C1=O
Systematic name  (3)：
  • 3-(3,4-ジメトキシフェニル)-3α-(3-オキソブチル)-2-オキソピロリジン-1-カルボン酸tert-ブチル
  • tert-ブチル (3R)-3-(3,4-ジメトキシフェニル)-2-オキソ-3-(3-オキソブチル)ピロリジン-1-カルボキシラート
  • tert-butyl (3R)-3-(3,4-dimethoxyphenyl)-2-oxo-3-(3-oxobutyl)pyrrolidine-1-carboxylate
Other name (1)：
  • 3-(3,4-Dimethoxyphenyl)-3α-(3-oxobutyl)-2-oxopyrrolidine-1-carboxylic acid tert-butyl ester
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