Chem
J-GLOBAL ID:200907018564929111   Nikkaji number:J1.457.301A

(3aR)-1-tert-Butyl-2-fluoro-1,3aα,4,9bα-tetrahydro[1]benzopyrano[4,3-b]pyrrole-3-carboxylic acid ethyl ester

(3aR)-1-tert-ブチル-2-フルオロ-1,3aα,4,9bα-テトラヒドロ[1]ベンゾピラノ[4,3-b]ピロール-3-カルボン酸エチル
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: C18H22FNO3
Molecular formula furigana: C18-H22-F-N-O3
Molecular weight: 319.376
InChI: InChI=1S/C18H22FNO3/c1-5-22-17(21)14-12-10-23-13-9-7-6-8-11(13)15(12)20(16(14)19)18(2,3)4/h6-9,12,15H,5,10H2,1-4H3/t12-,15-/m1/s1
InChI key: MKTNXXOOWVHKPH-IUODEOHRSA-N
SMILES: CCOC(=O)C1=C(F)N([C@H]2[C@@H]1COc1ccccc21)C(C)(C)C
Systematic name  (3):
  • (3aR)-1-tert-ブチル-2-フルオロ-1,3aα,4,9bα-テトラヒドロ[1]ベンゾピラノ[4,3-b]ピロール-3-カルボン酸エチル
  • エチル (2S,6R)-3-tert-ブチル-4-フルオロ-8-オキサ-3-アザトリシクロ[7.4.0.02,6]トリデカ-1(13),4,9,11-テトラエン-5-カルボキシラート
  • ethyl (2S,6R)-3-tert-butyl-4-fluoro-8-oxa-3-azatricyclo[7.4.0.02,6]trideca-1(13),4,9,11-tetraene-5-carboxylate
Other name (1):
  • (3aR)-1-tert-Butyl-2-fluoro-1,3aα,4,9bα-tetrahydro[1]benzopyrano[4,3-b]pyrrole-3-carboxylic acid ethyl ester
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