Chem
J-GLOBAL ID:200907049262029076   Nikkaji number:J2.347.528F

(1R)-1β-(Pentafluorophenyl)-2-allyl-5α,7aα-epoxy-2,3,3aβ,4,5,7a-hexahydro-1H-isoindole

(1R)-1β-(ペンタフルオロフェニル)-2-アリル-5α,7aα-エポキシ-2,3,3aβ,4,5,7a-ヘキサヒドロ-1H-イソインドール
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: C17H14F5NO
Molecular formula furigana: C17-H14-F5-N-O
Molecular weight: 343.297
InChI: InChI=1S/C17H14F5NO/c1-2-5-23-7-8-6-9-3-4-17(8,24-9)16(23)10-11(18)13(20)15(22)14(21)12(10)19/h2-4,8-9,16H,1,5-7H2/t8-,9+,16+,17-/m0/s1
InChI key: BAZAYGKQKYQGHB-YCLQXWMPSA-N
SMILES: Fc1c(F)c(F)c([C@H]2N(CC=C)C[C@@H]3C[C@@H]4O[C@]23C=C4)c(F)c1F
Systematic name  (3):
  • (1R)-1β-(ペンタフルオロフェニル)-2-アリル-5α,7aα-エポキシ-2,3,3aβ,4,5,7a-ヘキサヒドロ-1H-イソインドール
  • (1S,2R,5S,7S)-2-(2,3,4,5,6-ペンタフルオロフェニル)-3-(プロパ-2-エン-1-イル)-10-オキサ-3-アザトリシクロ[5.2.1.01,5]デカ-8-エン
  • (1S,2R,5S,7S)-2-(2,3,4,5,6-pentafluorophenyl)-3-(prop-2-en-1-yl)-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene
Other name (1):
  • (1R)-1β-(Pentafluorophenyl)-2-allyl-5α,7aα-epoxy-2,3,3aβ,4,5,7a-hexahydro-1H-isoindole
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