Chem
J-GLOBAL ID：200907008327447395   Nikkaji number：J1.515.017C

4-[[(2S)-2-Fluorooctyl]oxy]benzoic acid 4′-[10-(2-thienylcarbonyloxy)decyloxy]biphenyl-4-yl ester

4-[[(2S)-2-フルオロオクチル]オキシ]安息香酸4′-[10-(2-チエニルカルボニルオキシ)デシルオキシ]ビフェニル-4-イル
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： C42H51FO6S
Molecular formula furigana： C42-H51-F-O6-S
Molecular weight： 702.920
InChI： InChI=1S/C42H51FO6S/c1-2-3-4-11-15-36(43)32-48-38-25-21-35(22-26-38)41(44)49-39-27-19-34(20-28-39)33-17-23-37(24-18-33)46-29-12-9-7-5-6-8-10-13-30-47-42(45)40-16-14-31-50-40/h14,16-28,31,36H,2-13,15,29-30,32H2,1H3/t36-/m0/s1
InChI key： COHGCAQGHPRONN-BHVANESWSA-N
SMILES： CCCCCC[C@H](F)COc1ccc(cc1)C(=O)Oc1ccc(cc1)c1ccc(OCCCCCCCCCCOC(=O)c2cccs2)cc1
Systematic name  (3)：
  • 4-[[(2S)-2-フルオロオクチル]オキシ]安息香酸4′-[10-(2-チエニルカルボニルオキシ)デシルオキシ]ビフェニル-4-イル
  • 10-{[4'-(4-{[(2S)-2-フルオロオクチル]オキシ}ベンゾイルオキシ)-[1,1'-ビフェニル]-4-イル]オキシ}デシル チオフェン-2-カルボキシラート
  • 10-{[4'-(4-{[(2S)-2-fluorooctyl]oxy}benzoyloxy)-[1,1'-biphenyl]-4-yl]oxy}decyl thiophene-2-carboxylate
Other name (1)：
  • 4-[[(2S)-2-Fluorooctyl]oxy]benzoic acid 4′-[10-(2-thienylcarbonyloxy)decyloxy]biphenyl-4-yl ester
Thsaurus map：
Thesaurus Map

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