Chem
J-GLOBAL ID:200907025770077527   Nikkaji number:J2.441.952E

3,4,5-Tris(tetradecyloxy)benzoic acid 4-[3-(4-cyanophenyl)-3-oxo-1-propenyl]phenyl ester

3,4,5-トリス(テトラデシルオキシ)安息香酸4-[3-(4-シアノフェニル)-3-オキソ-1-プロペニル]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: C65H99NO6
Molecular formula furigana: C65-H99-N-O6
Molecular weight: 990.508
InChI: InChI=1S/C65H99NO6/c1-4-7-10-13-16-19-22-25-28-31-34-37-50-69-62-53-59(65(68)72-60-47-42-56(43-48-60)44-49-61(67)58-45-40-57(55-66)41-46-58)54-63(70-51-38-35-32-29-26-23-20-17-14-11-8-5-2)64(62)71-52-39-36-33-30-27-24-21-18-15-12-9-6-3/h40-49,53-54H,4-39,50-52H2,1-3H3
InChI key: RVHYMIYLTTYRRH-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCOc1cc(cc(OCCCCCCCCCCCCCC)c1OCCCCCCCCCCCCCC)C(=O)Oc1ccc(C=CC(=O)c2ccc(cc2)C#N)cc1
Systematic name  (3):
  • 3,4,5-トリス(テトラデシルオキシ)安息香酸4-[3-(4-シアノフェニル)-3-オキソ-1-プロペニル]フェニル
  • 4-[3-(4-シアノフェニル)-3-オキソプロパ-1-エン-1-イル]フェニル 3,4,5-トリス(テトラデシルオキシ)ベンゾアート
  • 4-[3-(4-cyanophenyl)-3-oxoprop-1-en-1-yl]phenyl 3,4,5-tris(tetradecyloxy)benzoate
Other name (1):
  • 3,4,5-Tris(tetradecyloxy)benzoic acid 4-[3-(4-cyanophenyl)-3-oxo-1-propenyl]phenyl ester
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