Chem
J-GLOBAL ID：201707020478163286   Nikkaji number：J3.562.682D

3,3′-(2,5-Dimethoxy-1,4-phenylene)bis[2-[4-[6-(4-methylphenoxy)hexyloxy]phenyl]acrylonitrile]

3,3′-(2,5-ジメトキシ-1,4-フェニレン)ビス[2-[4-[6-(4-メチルフェノキシ)ヘキシルオキシ]フェニル]アクリロニトリル]
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： C52H56N2O6
Molecular formula furigana： C52-H56-N2-O6
Molecular weight： 805.028
InChI： InChI=1S/C52H56N2O6/c1-39-13-21-47(22-14-39)57-29-9-5-7-11-31-59-49-25-17-41(18-26-49)45(37-53)33-43-35-52(56-4)44(36-51(43)55-3)34-46(38-54)42-19-27-50(28-20-42)60-32-12-8-6-10-30-58-48-23-15-40(2)16-24-48/h13-28,33-36H,5-12,29-32H2,1-4H3
InChI key： TWDMRWUZOWEVKE-UHFFFAOYSA-N
SMILES： COc1cc(C=C(C#N)c2ccc(OCCCCCCOc3ccc(C)cc3)cc2)c(OC)cc1C=C(C#N)c1ccc(OCCCCCCOc2ccc(C)cc2)cc1
Systematic name  (5)：
  • 3,3′-(2,5-ジメトキシ-1,4-フェニレン)ビス[2-[4-[6-(4-メチルフェノキシ)ヘキシルオキシ]フェニル]アクリロニトリル]
  • 2,2′-ビス[4-[6-(4-メチルフェノキシ)ヘキシルオキシ]フェニル][3,3′-(2,5-ジメトキシ-1,4-フェニレン)ビス(プロペンニトリル)]
  • 3,3′-(2,5-ジメトキシ-1,4-フェニレン)ビス[2-[4-[6-(4-メチルフェノキシ)ヘキシルオキシ]フェニル]プロペンニトリル]
  • 3-{4-[2-シアノ-2-(4-{[6-(4-メチルフェノキシ)ヘキシル]オキシ}フェニル)エタ-1-エン-1-イル]-2,5-ジメトキシフェニル}-2-(4-{[6-(4-メチルフェノキシ)ヘキシル]オキシ}フェニル)プロパ-2-エンニトリル
  • 3-{4-[2-cyano-2-(4-{[6-(4-methylphenoxy)hexyl]oxy}phenyl)eth-1-en-1-yl]-2,5-dimethoxyphenyl}-2-(4-{[6-(4-methylphenoxy)hexyl]oxy}phenyl)prop-2-enenitrile
Other name (3)：
  • 3,3′-(2,5-Dimethoxy-1,4-phenylene)bis[2-[4-[6-(4-methylphenoxy)hexyloxy]phenyl]acrylonitrile]
  • 2,2′-Bis[4-[6-(4-methylphenoxy)hexyloxy]phenyl][3,3′-(2,5-dimethoxy-1,4-phenylene)bis(propenenitrile)]
  • 3,3′-(2,5-Dimethoxy-1,4-phenylene)bis[2-[4-[6-(4-methylphenoxy)hexyloxy]phenyl]propenenitrile]
Thsaurus map：
Thesaurus Map

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