Chem
J-GLOBAL ID:200907049672452871   Nikkaji number:J2.286.006B

4-[[4′-[[11-(1-Oxo-2-cyclohexylethoxy)undecyl]oxy]-4-biphenylyl]oxy]benzoic acid (R)-1-methylheptyl ester

4-[[4′-[[11-(1-オキソ-2-シクロヘキシルエトキシ)ウンデシル]オキシ]-4-ビフェニリル]オキシ]安息香酸(R)-1-メチルヘプチル
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: C46H64O6
Molecular formula furigana: C46-H64-O6
Molecular weight: 713.012
InChI: InChI=1S/C46H64O6/c1-3-4-5-14-19-37(2)51-46(48)41-26-32-44(33-27-41)52-43-30-24-40(25-31-43)39-22-28-42(29-23-39)49-34-17-11-9-7-6-8-10-12-18-35-50-45(47)36-38-20-15-13-16-21-38/h22-33,37-38H,3-21,34-36H2,1-2H3/t37-/m1/s1
InChI key: GEVZFDFXAWXFBZ-DIPNUNPCSA-N
SMILES: CCCCCC[C@@H](C)OC(=O)c1ccc(Oc2ccc(cc2)c2ccc(OCCCCCCCCCCCOC(=O)CC3CCCCC3)cc2)cc1
Systematic name  (3):
  • 4-[[4′-[[11-(1-オキソ-2-シクロヘキシルエトキシ)ウンデシル]オキシ]-4-ビフェニリル]オキシ]安息香酸(R)-1-メチルヘプチル
  • (2R)-オクタン-2-イル 4-{[4'-({11-[(2-シクロヘキシルアセチル)オキシ]ウンデシル}オキシ)-[1,1'-ビフェニル]-4-イル]オキシ}ベンゾアート
  • (2R)-octan-2-yl 4-{[4'-({11-[(2-cyclohexylacetyl)oxy]undecyl}oxy)-[1,1'-biphenyl]-4-yl]oxy}benzoate
Other name (1):
  • 4-[[4′-[[11-(1-Oxo-2-cyclohexylethoxy)undecyl]oxy]-4-biphenylyl]oxy]benzoic acid (R)-1-methylheptyl ester
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