Chem
J-GLOBAL ID：200907005597344327   Nikkaji number：J2.077.863F

(αS,1S)-α-Cyano-2β-(tert-butyldimethylsiloxy)-5-oxocyclohexane-1β-acetic acid ethyl ester

(αS,1S)-α-シアノ-2β-(tert-ブチルジメチルシロキシ)-5-オキソシクロヘキサン-1β-酢酸エチル
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： C17H29NO4Si
Molecular formula furigana： C17-H29-N-O4-SI
Molecular weight： 339.507
InChI： InChI=1S/C17H29NO4Si/c1-7-21-16(20)14(11-18)13-10-12(19)8-9-15(13)22-23(5,6)17(2,3)4/h13-15H,7-10H2,1-6H3/t13-,14+,15-/m0/s1
InChI key： DBZOSZQPXYLCGP-ZNMIVQPWSA-N
SMILES： CCOC(=O)[C@H](C#N)[C@@H]1CC(=O)CC[C@@H]1O[Si](C)(C)C(C)(C)C
Systematic name  (3)：
  • (αS,1S)-α-シアノ-2β-(tert-ブチルジメチルシロキシ)-5-オキソシクロヘキサン-1β-酢酸エチル
  • エチル (2S)-2-[(1S,2S)-2-[(tert-ブチルジメチルシリル)オキシ]-5-オキソシクロヘキシル]-2-シアノアセタート
  • ethyl (2S)-2-[(1S,2S)-2-[(tert-butyldimethylsilyl)oxy]-5-oxocyclohexyl]-2-cyanoacetate
Other name (1)：
  • (αS,1S)-α-Cyano-2β-(tert-butyldimethylsiloxy)-5-oxocyclohexane-1β-acetic acid ethyl ester
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