Chem
J-GLOBAL ID：200907093546847851
Nikkaji number：J1.536.535H
1,1′-[2-[6-(4′-Cyanobiphenyl-4-yloxy)hexyloxycarbonyl]-1,4-phenylenevinylene[2-[6-(4′-cyanobiphenyl-4-yloxy)hexyloxycarbonyl]-1,4-phenylene]vinylene[2-[6-(4′-cyanobiphenyl-4-yloxy)hexyloxycarbonyl]-1,4-phenylene]]bisethene
1,1′-[2-[6-(4′-シアノビフェニル-4-イルオキシ)ヘキシルオキシカルボニル]-1,4-フェニレンビニレン[2-[6-(4′-シアノビフェニル-4-イルオキシ)ヘキシルオキシカルボニル]-1,4-フェニレン]ビニレン[2-[6-(4′-シアノビフェニル-4-イルオキシ)ヘキシルオキシカルボニル]-1,4-フェニレン]]ビスエテン
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
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
Molecular formula： C86H79N3O9
Molecular formula furigana： C86-H79-N3-O9
Molecular weight： 1298.590
InChI：
InChI=1S/C86H79N3O9/c1-3-63-17-35-76(82(57-63)85(91)97-55-15-9-6-12-52-94-79-47-41-74(42-48-79)71-31-24-67(61-88)25-32-71)36-20-65-21-38-77(83(59-65)86(92)98-56-16-10-7-13-53-95-80-49-43-75(44-50-80)72-33-26-68(62-89)27-34-72)37-19-64-18-28-69(4-2)81(58-64)84(90)96-54-14-8-5-11-51-93-78-45-39-73(40-46-78)70-29-22-66(60-87)23-30-70/h3-4,17-50,57-59H,1-2,5-16,51-56H2
InChI key：
SQKLAUDRRYPWGQ-UHFFFAOYSA-N
SMILES：
C=Cc1ccc(C=Cc2ccc(C=Cc3ccc(C=C)c(c3)C(=O)OCCCCCCOc3ccc(cc3)c3ccc(cc3)C#N)c(c2)C(=O)OCCCCCCOc2ccc(cc2)c2ccc(cc2)C#N)c(c1)C(=O)OCCCCCCOc1ccc(cc1)c1ccc(cc1)C#N
Systematic name (3)：
- 1,1′-[2-[6-(4′-シアノビフェニル-4-イルオキシ)ヘキシルオキシカルボニル]-1,4-フェニレンビニレン[2-[6-(4′-シアノビフェニル-4-イルオキシ)ヘキシルオキシカルボニル]-1,4-フェニレン]ビニレン[2-[6-(4′-シアノビフェニル-4-イルオキシ)ヘキシルオキシカルボニル]-1,4-フェニレン]]ビスエテン
- 6-({4'-シアノ-[1,1'-ビフェニル]-4-イル}オキシ)ヘキシル 2-{2-[3-({[6-({4'-シアノ-[1,1'-ビフェニル]-4-イル}オキシ)ヘキシル]オキシ}カルボニル)-4-{2-[3-({[6-({4'-シアノ-[1,1'-ビフェニル]-4-イル}オキシ)ヘキシル]オキシ}カルボニル)-4-エテニルフェニル]エテニル}フェニル]エテニル}-5-エテニルベンゾアート
- 6-({4'-cyano-[1,1'-biphenyl]-4-yl}oxy)hexyl 2-{2-[3-({[6-({4'-cyano-[1,1'-biphenyl]-4-yl}oxy)hexyl]oxy}carbonyl)-4-{2-[3-({[6-({4'-cyano-[1,1'-biphenyl]-4-yl}oxy)hexyl]oxy}carbonyl)-4-ethenylphenyl]ethenyl}phenyl]ethenyl}-5-ethenylbenzoate
- 1,1′-[2-[6-(4′-Cyanobiphenyl-4-yloxy)hexyloxycarbonyl]-1,4-phenylenevinylene[2-[6-(4′-cyanobiphenyl-4-yloxy)hexyloxycarbonyl]-1,4-phenylene]vinylene[2-[6-(4′-cyanobiphenyl-4-yloxy)hexyloxycarbonyl]-1,4-phenylene]]bisethene
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