Chem
J-GLOBAL ID:201207006432354583   Nikkaji number:J3.012.892C

9,10-Bis[3,5-bis(benzyloxy)benzyloxy]-3,6-bis[(4-pyridyl)ethynyl]phenanthrene

9,10-ビス[3,5-ビス(ベンジルオキシ)ベンジルオキシ]-3,6-ビス[(4-ピリジル)エチニル]フェナントレン
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: C70H52N2O6
Molecular formula furigana: C70-H52-N2-O6
Molecular weight: 1017.194
InChI: InChI=1S/C70H52N2O6/c1-5-13-55(14-6-1)45-73-61-37-59(38-62(43-61)74-46-56-15-7-2-8-16-56)49-77-69-65-27-25-53(23-21-51-29-33-71-34-30-51)41-67(65)68-42-54(24-22-52-31-35-72-36-32-52)26-28-66(68)70(69)78-50-60-39-63(75-47-57-17-9-3-10-18-57)44-64(40-60)76-48-58-19-11-4-12-20-58/h1-20,25-44H,45-50H2
InChI key: ABWGNHHTYDBZMU-UHFFFAOYSA-N
SMILES: C(Oc1cc(COc2c(OCc3cc(OCc4ccccc4)cc(OCc4ccccc4)c3)c3ccc(cc3c3cc(ccc23)C#Cc2ccncc2)C#Cc2ccncc2)cc(OCc2ccccc2)c1)c1ccccc1
Systematic name  (3):
  • 9,10-ビス[3,5-ビス(ベンジルオキシ)ベンジルオキシ]-3,6-ビス[(4-ピリジル)エチニル]フェナントレン
  • 4-{2-[9,10-ビス({[3,5-ビス(ベンジルオキシ)フェニル]メトキシ})-6-[2-(ピリジン-4-イル)エチニル]フェナントレン-3-イル]エチニル}ピリジン
  • 4-{2-[9,10-bis({[3,5-bis(benzyloxy)phenyl]methoxy})-6-[2-(pyridin-4-yl)ethynyl]phenanthren-3-yl]ethynyl}pyridine
Other name (1):
  • 9,10-Bis[3,5-bis(benzyloxy)benzyloxy]-3,6-bis[(4-pyridyl)ethynyl]phenanthrene
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