Chem
J-GLOBAL ID:200907006679058353   Nikkaji number:J1.481.650J

(4aR,4aα,8aβ)-6β-[4-(Trifluoromethoxy)phenyl]-2-(4-butoxyphenyl)hexahydropyrano[3,2-d]-1,3-dioxin

(4aR,4aα,8aβ)-6β-[4-(トリフルオロメトキシ)フェニル]-2-(4-ブトキシフェニル)ヘキサヒドロピラノ[3,2-d]-1,3-ジオキシン
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: C24H27F3O5
Molecular formula furigana: C24-H27-F3-O5
Molecular weight: 452.470
InChI: InChI=1S/C24H27F3O5/c1-2-3-14-28-18-8-6-17(7-9-18)23-29-15-22-21(31-23)13-12-20(30-22)16-4-10-19(11-5-16)32-24(25,26)27/h4-11,20-23H,2-3,12-15H2,1H3/t20-,21+,22-,23?/m1/s1
InChI key: IBMGUOLFDMJAIS-VNYJYPEVSA-N
SMILES: CCCCOc1ccc(cc1)C1OC[C@H]2O[C@H](CC[C@@H]2O1)c1ccc(OC(F)(F)F)cc1
Systematic name  (3):
  • (4aR,4aα,8aβ)-6β-[4-(トリフルオロメトキシ)フェニル]-2-(4-ブトキシフェニル)ヘキサヒドロピラノ[3,2-d]-1,3-ジオキシン
  • (4aR,6R,8aS)-2-(4-ブトキシフェニル)-6-[4-(トリフルオロメトキシ)フェニル]-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン
  • (4aR,6R,8aS)-2-(4-butoxyphenyl)-6-[4-(trifluoromethoxy)phenyl]-hexahydro-2H-pyrano[3,2-d][1,3]dioxine
Other name (1):
  • (4aR,4aα,8aβ)-6β-[4-(Trifluoromethoxy)phenyl]-2-(4-butoxyphenyl)hexahydropyrano[3,2-d]-1,3-dioxin
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