Chem
J-GLOBAL ID:200907016164821335   Nikkaji number:J1.230.064F

4-[4-[4-(4-Phenoxyphenoxy)phenoxy]phenoxy]benzoic acid [(1R,2R,4S)-bicyclo[2.2.1]hepta-5-ene-2-yl]methyl ester

4-[4-[4-(4-フェノキシフェノキシ)フェノキシ]フェノキシ]安息香酸[(1R,2R,4S)-ビシクロ[2.2.1]ヘプタ-5-エン-2-イル]メチル
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: C39H32O6
Molecular formula furigana: C39-H32-O6
Molecular weight: 596.679
InChI: InChI=1S/C39H32O6/c40-39(41-26-30-25-27-6-7-29(30)24-27)28-8-10-32(11-9-28)43-34-16-18-36(19-17-34)45-38-22-20-37(21-23-38)44-35-14-12-33(13-15-35)42-31-4-2-1-3-5-31/h1-23,27,29-30H,24-26H2/t27-,29-,30-/m0/s1
InChI key: VCRUQBQUGYOKKH-BKHJTQGXSA-N
SMILES: O=C(OC[C@@H]1C[C@@H]2C[C@@H]1C=C2)c1ccc(Oc2ccc(Oc3ccc(Oc4ccc(Oc5ccccc5)cc4)cc3)cc2)cc1
Systematic name  (3):
  • 4-[4-[4-(4-フェノキシフェノキシ)フェノキシ]フェノキシ]安息香酸[(1R,2R,4S)-ビシクロ[2.2.1]ヘプタ-5-エン-2-イル]メチル
  • [(1R,2R,4S)-ビシクロ[2.2.1]ヘプタ-5-エン-2-イル]メチル 4-{4-[4-(4-フェノキシフェノキシ)フェノキシ]フェノキシ}ベンゾアート
  • [(1R,2R,4S)-bicyclo[2.2.1]hept-5-en-2-yl]methyl 4-{4-[4-(4-phenoxyphenoxy)phenoxy]phenoxy}benzoate
Other name (1):
  • 4-[4-[4-(4-Phenoxyphenoxy)phenoxy]phenoxy]benzoic acid [(1R,2R,4S)-bicyclo[2.2.1]hepta-5-ene-2-yl]methyl ester
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