Chem
J-GLOBAL ID:200907047191122360
Nikkaji number:J2.612.462J
2,6-Bis[[6-(1-dodecynyl)-4-(octyloxy)-2-pyridyl]ethynyl]pyridine-4(1H)-one
2,6-ビス[[6-(1-ドデシニル)-4-(オクチルオキシ)-2-ピリジル]エチニル]ピリジン-4(1H)-オン
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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:
C59 H83 N3 O3
Molecular formula furigana:
C59-H83-N3-O3
Molecular weight:
882.331
InChI:
InChI=1S/C59H83N3O3/c1-5-9-13-17-21-23-25-27-29-33-37-51-47-58(64-43-35-31-19-15-11-7-3)49-55(60-51)41-39-53-45-57(63)46-54(62-53)40-42-56-50-59(65-44-36-32-20-16-12-8-4)48-52(61-56)38-34-30-28-26-24-22-18-14-10-6-2/h45-50H,5-32,35-36,43-44H2,1-4H3,(H,62,63)
InChI key:
SGKIXCDJFPFZKN-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCC#Cc1cc(OCCCCCCCC)cc(n1)C#Cc1cc(=O)cc([nH]1)C#Cc1cc(OCCCCCCCC)cc(n1)C#CCCCCCCCCCC
Systematic name (3):
2,6-ビス[[6-(1-ドデシニル)-4-(オクチルオキシ)-2-ピリジル]エチニル]ピリジン-4(1H)-オン
2,6-ビス({2-[6-(ドデカ-1-イン-1-イル)-4-(オクチルオキシ)ピリジン-2-イル]エチニル})-1,4-ジヒドロピリジン-4-オン
2,6-bis({2-[6-(dodec-1-yn-1-yl)-4-(octyloxy)pyridin-2-yl]ethynyl})-1,4-dihydropyridin-4-one
Other name (1):
2,6-Bis[[6-(1-dodecynyl)-4-(octyloxy)-2-pyridyl]ethynyl]pyridine-4(1H)-one
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