Chem
J-GLOBAL ID：201507016664145210   Nikkaji number：J3.449.008B

(3aS,6aR)-2-Boc-5-(2-Trifluoromethylphenyl)-1,2,3,3a,4,6a-hexahydrocyclopenta[c]pyrrole

(3aS,6aR)-2-Boc-5-(2-トリフルオロメチルフェニル)-1,2,3,3a,4,6a-ヘキサヒドロシクロペンタ[c]ピロール
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： C19H22F3NO2
Molecular formula furigana： C19-H22-F3-N-O2
Molecular weight： 353.385
InChI： InChI=1S/C19H22F3NO2/c1-18(2,3)25-17(24)23-10-13-8-12(9-14(13)11-23)15-6-4-5-7-16(15)19(20,21)22/h4-8,13-14H,9-11H2,1-3H3/t13-,14+/m0/s1
InChI key： MGNXHKSVPKSQRY-UONOGXRCSA-N
SMILES： CC(C)(C)OC(=O)N1C[C@H]2CC(=C[C@H]2C1)c1ccccc1C(F)(F)F
Systematic name  (3)：
  • (3aS,6aR)-2-Boc-5-(2-トリフルオロメチルフェニル)-1,2,3,3a,4,6a-ヘキサヒドロシクロペンタ[c]ピロール
  • tert-ブチル (3aS,6aR)-5-[2-(トリフルオロメチル)フェニル]-1H,2H,3H,3aH,4H,6aH-シクロペンタ[c]ピロール-2-カルボキシラート
  • tert-butyl (3aS,6aR)-5-[2-(trifluoromethyl)phenyl]-1H,2H,3H,3aH,4H,6aH-cyclopenta[c]pyrrole-2-carboxylate
Other name (1)：
  • (3aS,6aR)-2-Boc-5-(2-Trifluoromethylphenyl)-1,2,3,3a,4,6a-hexahydrocyclopenta[c]pyrrole
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