Chem
J-GLOBAL ID:200907056828294836   Nikkaji number:J1.270.015F

Bis[4-(hexyloxy)benzoic acid]1,9-nonanediylbis[nitrilomethylidyne(4,1-phenylene)] ester

ビス[4-(ヘキシルオキシ)安息香酸]1,9-ノナンジイルビス[ニトリロメチリジン(4,1-フェニレン)]
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: C49H62N2O6
Molecular formula furigana: C49-H62-N2-O6
Molecular weight: 775.043
InChI: InChI=1S/C49H62N2O6/c1-3-5-7-16-36-54-44-30-22-42(23-31-44)48(52)56-46-26-18-40(19-27-46)38-50-34-14-12-10-9-11-13-15-35-51-39-41-20-28-47(29-21-41)57-49(53)43-24-32-45(33-25-43)55-37-17-8-6-4-2/h18-33,38-39H,3-17,34-37H2,1-2H3
InChI key: NIFHHQKFZSDBGV-UHFFFAOYSA-N
SMILES: CCCCCCOc1ccc(cc1)C(=O)Oc1ccc(C=NCCCCCCCCCN=Cc2ccc(OC(=O)c3ccc(OCCCCCC)cc3)cc2)cc1
Systematic name  (4):
  • ビス[4-(ヘキシルオキシ)安息香酸]1,9-ノナンジイルビス(ニトリロメチリジン)ビス(4,1-フェニレン)
  • ビス[4-(ヘキシルオキシ)安息香酸]1,9-ノナンジイルビス[ニトリロメチリジン(4,1-フェニレン)]
  • 4-[({9-[({4-[4-(ヘキシルオキシ)ベンゾイルオキシ]フェニル}メチリデン)アミノ]ノニル}イミノ)メチル]フェニル 4-(ヘキシルオキシ)ベンゾアート
  • 4-[({9-[({4-[4-(hexyloxy)benzoyloxy]phenyl}methylidene)amino]nonyl}imino)methyl]phenyl 4-(hexyloxy)benzoate
Other name (2):
  • Bis[4-(hexyloxy)benzoic acid]1,9-nonanediylbis(nitrilomethylidyne)bis(4,1-phenylene) ester
  • Bis[4-(hexyloxy)benzoic acid]1,9-nonanediylbis[nitrilomethylidyne(4,1-phenylene)] ester
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