Chem
J-GLOBAL ID:201807005451983158   Nikkaji number:J3.722.303D

N,N′-[4,5,6-Tris(dodecyloxy)-1,3-phenylenebis(methyleneoxy-p-phenylenevinylene-p-phenylene)]bis[(3R)-3,7-dimethyloctaneamide]

N,N′-[4,5,6-トリス(ドデシルオキシ)-1,3-フェニレンビス(メチレンオキシ-p-フェニレンビニレン-p-フェニレン)]ビス[(3R)-3,7-ジメチルオクタンアミド]
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: C92H140N2O7
Molecular formula furigana: C92-H140-N2-O7
Molecular weight: 1386.139
InChI: InChI=1S/C92H140N2O7/c1-10-13-16-19-22-25-28-31-34-37-66-97-90-82(72-100-86-62-54-80(55-63-86)48-46-78-50-58-84(59-51-78)93-88(95)69-76(8)44-40-42-74(4)5)71-83(91(98-67-38-35-32-29-26-23-20-17-14-11-2)92(90)99-68-39-36-33-30-27-24-21-18-15-12-3)73-101-87-64-56-81(57-65-87)49-47-79-52-60-85(61-53-79)94-89(96)70-77(9)45-41-43-75(6)7/h46-65,71,74-77H,10-45,66-70,72-73H2,1-9H3,(H,93,95)(H,94,96)/t76-,77-/m1/s1
InChI key: DTKRFKQPVLHKMG-KZCWQMDCSA-N
SMILES: CCCCCCCCCCCCOc1c(COc2ccc(C=Cc3ccc(NC(=O)C[C@H](C)CCCC(C)C)cc3)cc2)cc(COc2ccc(C=Cc3ccc(NC(=O)C[C@H](C)CCCC(C)C)cc3)cc2)c(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC
Systematic name  (3):
  • N,N′-[4,5,6-トリス(ドデシルオキシ)-1,3-フェニレンビス(メチレンオキシ-p-フェニレンビニレン-p-フェニレン)]ビス[(3R)-3,7-ジメチルオクタンアミド]
  • (3R)-N-[4-(2-{4-[(5-{[4-(2-{4-[(3R)-3,7-ジメチルオクタンアミド]フェニル}エテニル)フェノキシ]メチル}-2,3,4-トリス(ドデシルオキシ)フェニル)メトキシ]フェニル}エテニル)フェニル]-3,7-ジメチルオクタンアミド
  • (3R)-N-[4-(2-{4-[(5-{[4-(2-{4-[(3R)-3,7-dimethyloctanamido]phenyl}ethenyl)phenoxy]methyl}-2,3,4-tris(dodecyloxy)phenyl)methoxy]phenyl}ethenyl)phenyl]-3,7-dimethyloctanamide
Other name (1):
  • N,N′-[4,5,6-Tris(dodecyloxy)-1,3-phenylenebis(methyleneoxy-p-phenylenevinylene-p-phenylene)]bis[(3R)-3,7-dimethyloctaneamide]
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