Chem
J-GLOBAL ID：200907080714621860   Nikkaji number：J1.514.081J

(4aS,7S)-2-Oxo-2′,2′-dimethyl-3-benzyl-5β-[2-(tert-butyldimethylsiloxy)ethyl]-2,4a,5,6,8,8aβ-hexahydrospiro[7H-1,4-benzoxazine-7,4′-[1,3]dioxolane]-4aβ-carbonitrile

(4aS,7S)-2-オキソ-2′,2′-ジメチル-3-ベンジル-5β-[2-(tert-ブチルジメチルシロキシ)エチル]-2,4a,5,6,8,8aβ-ヘキサヒドロスピロ[7H-1,4-ベンゾオキサジン-7,4′-[1,3]ジオキソラン]-4aβ-カルボニトリル
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： C28H40N2O5Si
Molecular formula furigana： C28-H40-N2-O5-SI
Molecular weight： 512.722
InChI： InChI=1S/C28H40N2O5Si/c1-25(2,3)36(6,7)33-14-13-21-16-27(19-32-26(4,5)35-27)17-23-28(21,18-29)30-22(24(31)34-23)15-20-11-9-8-10-12-20/h8-12,21,23H,13-17,19H2,1-7H3/t21-,23-,27-,28+/m0/s1
InChI key： JRKPUVLARZTTIZ-LNOYQOGMSA-N
SMILES： CC(C)(C)[Si](C)(C)OCC[C@H]1C[C@@]2(COC(C)(C)O2)C[C@@H]2OC(=O)C(=N[C@]12C#N)Cc1ccccc1
Systematic name  (3)：
  • (4aS,7S)-2-オキソ-2′,2′-ジメチル-3-ベンジル-5β-[2-(tert-ブチルジメチルシロキシ)エチル]-2,4a,5,6,8,8aβ-ヘキサヒドロスピロ[7H-1,4-ベンゾオキサジン-7,4′-[1,3]ジオキソラン]-4aβ-カルボニトリル
  • (4aS,5S,7S,8aS)-3-ベンジル-5-{2-[(tert-ブチルジメチルシリル)オキシ]エチル}-5',5'-ジメチル-2-オキソ-2,4a,5,6,8,8a-ヘキサヒドロスピロ[1,4-ベンゾオキサジン-7,2'-[1,4]ジオキソラン]-4a-カルボニトリル
  • (4aS,5S,7S,8aS)-3-benzyl-5-{2-[(tert-butyldimethylsilyl)oxy]ethyl}-5',5'-dimethyl-2-oxo-2,4a,5,6,8,8a-hexahydrospiro[1,4-benzoxazine-7,2'-[1,4]dioxolane]-4a-carbonitrile
Other name (1)：
  • (4aS,7S)-2-Oxo-2′,2′-dimethyl-3-benzyl-5β-[2-(tert-butyldimethylsiloxy)ethyl]-2,4a,5,6,8,8aβ-hexahydrospiro[7H-1,4-benzoxazine-7,4′-[1,3]dioxolane]-4aβ-carbonitrile
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