Chem
J-GLOBAL ID:200907026390075498   Nikkaji number:J281.491I

(R)-α-Formylbenzeneacetic acid (1β,5β)-8-(1-methylethyl)-8-azabicyclo[3.2.1]octan-3α-yl ester

(R)-α-ホルミルベンゼン酢酸(1β,5β)-8-(1-メチルエチル)-8-アザビシクロ[3.2.1]オクタン-3α-イル
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: C19H25NO3
Molecular formula furigana: C19-H25-N-O3
Molecular weight: 315.413
InChI: InChI=1S/C19H25NO3/c1-13(2)20-15-8-9-16(20)11-17(10-15)23-19(22)18(12-21)14-6-4-3-5-7-14/h3-7,12-13,15-18H,8-11H2,1-2H3/t15-,16+,17?,18-/m0/s1
InChI key: OAGQQBLOOSHJLU-WFFDWFOESA-N
SMILES: CC(C)N1[C@H]2CC[C@@H]1CC(C2)OC(=O)[C@@H](C=O)c1ccccc1
Systematic name  (3):
  • (R)-α-ホルミルベンゼン酢酸(1β,5β)-8-(1-メチルエチル)-8-アザビシクロ[3.2.1]オクタン-3α-イル
  • (1R,5S)-8-(プロパン-2-イル)-8-アザビシクロ[3.2.1]オクタン-3-イル (2R)-3-オキソ-2-フェニルプロパノアート
  • (1R,5S)-8-(propan-2-yl)-8-azabicyclo[3.2.1]octan-3-yl (2R)-3-oxo-2-phenylpropanoate
Other name (1):
  • (R)-α-Formylbenzeneacetic acid (1β,5β)-8-(1-methylethyl)-8-azabicyclo[3.2.1]octan-3α-yl ester
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