Chem
J-GLOBAL ID：200907048227411220   Nikkaji number：J1.065.093C

4,4,4-Trifluoro-3-(4-methoxyphenyl)butanoic acid 4-[5-[4-(octyloxy)phenyl]-2-pyrimidinyl]phenyl ester

4,4,4-トリフルオロ-3-(4-メトキシフェニル)ブタン酸4-[5-[4-(オクチルオキシ)フェニル]-2-ピリミジニル]フェニル
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： C35H37F3N2O4
Molecular formula furigana： C35-H37-F3-N2-O4
Molecular weight： 606.686
InChI： InChI=1S/C35H37F3N2O4/c1-3-4-5-6-7-8-21-43-30-17-9-25(10-18-30)28-23-39-34(40-24-28)27-13-19-31(20-14-27)44-33(41)22-32(35(36,37)38)26-11-15-29(42-2)16-12-26/h9-20,23-24,32H,3-8,21-22H2,1-2H3
InChI key： ZWEUEUGRUFFVDO-UHFFFAOYSA-N
SMILES： CCCCCCCCOc1ccc(cc1)c1cnc(nc1)c1ccc(OC(=O)CC(c2ccc(OC)cc2)C(F)(F)F)cc1
Systematic name  (4)：
  • 3-(4-メトキシフェニル)-4,4,4-トリフルオロブタン酸4-[5-[4-(オクチルオキシ)フェニル]ピリミジン-2-イル]フェニル
  • 4,4,4-トリフルオロ-3-(4-メトキシフェニル)ブタン酸4-[5-[4-(オクチルオキシ)フェニル]-2-ピリミジニル]フェニル
  • 4-{5-[4-(オクチルオキシ)フェニル]ピリミジン-2-イル}フェニル 4,4,4-トリフルオロ-3-(4-メトキシフェニル)ブタノアート
  • 4-{5-[4-(octyloxy)phenyl]pyrimidin-2-yl}phenyl 4,4,4-trifluoro-3-(4-methoxyphenyl)butanoate
Other name (2)：
  • 3-(4-Methoxyphenyl)-4,4,4-trifluorobutanoic acid 4-[5-[4-(octyloxy)phenyl]pyrimidine-2-yl]phenyl ester
  • 4,4,4-Trifluoro-3-(4-methoxyphenyl)butanoic acid 4-[5-[4-(octyloxy)phenyl]-2-pyrimidinyl]phenyl ester
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