Chem
J-GLOBAL ID:200907018236768437   Nikkaji number:J1.718.089D

(3S)-3β-(Acetoxymethyl)-4α-(4-fluorophenyl)-1-piperidinecarboxylic acid allyl ester

(3S)-3β-(アセトキシメチル)-4α-(4-フルオロフェニル)-1-ピペリジンカルボン酸アリル
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: C18H22FNO4
Molecular formula furigana: C18-H22-F-N-O4
Molecular weight: 335.375
InChI: InChI=1S/C18H22FNO4/c1-3-10-23-18(22)20-9-8-17(14-4-6-16(19)7-5-14)15(11-20)12-24-13(2)21/h3-7,15,17H,1,8-12H2,2H3/t15-,17-/m0/s1
InChI key: RHRRABRJLZZDFF-RDJZCZTQSA-N
SMILES: CC(=O)OC[C@@H]1CN(CC[C@H]1c1ccc(F)cc1)C(=O)OCC=C
Systematic name  (3):
  • (3S)-3β-(アセトキシメチル)-4α-(4-フルオロフェニル)-1-ピペリジンカルボン酸アリル
  • プロパ-2-エン-1-イル (3S,4R)-3-[(アセチルオキシ)メチル]-4-(4-フルオロフェニル)ピペリジン-1-カルボキシラート
  • prop-2-en-1-yl (3S,4R)-3-[(acetyloxy)methyl]-4-(4-fluorophenyl)piperidine-1-carboxylate
Other name (1):
  • (3S)-3β-(Acetoxymethyl)-4α-(4-fluorophenyl)-1-piperidinecarboxylic acid allyl ester
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