Chem
J-GLOBAL ID：201607020005530942
Nikkaji number：J3.528.405B
(2Z,2′Z)-3,3′-(p-Phenylene)bis[2-(1-octyl-1H-indole-3-yl)acrylonitrile]
(2Z,2′Z)-3,3′-(p-フェニレン)ビス[2-(1-オクチル-1H-インドール-3-イル)アクリロニトリル]
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： C44H50N4
Molecular formula furigana： C44-H50-N4
Molecular weight： 634.912
InChI：
InChI=1S/C44H50N4/c1-3-5-7-9-11-17-27-47-33-41(39-19-13-15-21-43(39)47)37(31-45)29-35-23-25-36(26-24-35)30-38(32-46)42-34-48(28-18-12-10-8-6-4-2)44-22-16-14-20-40(42)44/h13-16,19-26,29-30,33-34H,3-12,17-18,27-28H2,1-2H3/b37-29+,38-30+
InChI key：
SANDFXPUEBFFRQ-UDEUAJILSA-N
SMILES：
CCCCCCCCn1cc(/C(=C/c2ccc(/C=C(\C#N)/c3cn(CCCCCCCC)c4ccccc34)cc2)/C#N)c2ccccc12
Systematic name (3)：
- (2Z,2′Z)-3,3′-(p-フェニレン)ビス[2-(1-オクチル-1H-インドール-3-イル)アクリロニトリル]
- (2Z)-3-{4-[(1Z)-2-シアノ-2-(1-オクチル-1H-インドール-3-イル)エタ-1-エン-1-イル]フェニル}-2-(1-オクチル-1H-インドール-3-イル)プロパ-2-エンニトリル
- (2Z)-3-{4-[(1Z)-2-cyano-2-(1-octyl-1H-indol-3-yl)eth-1-en-1-yl]phenyl}-2-(1-octyl-1H-indol-3-yl)prop-2-enenitrile
- (2Z,2′Z)-3,3′-(p-Phenylene)bis[2-(1-octyl-1H-indole-3-yl)acrylonitrile]
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