Chem
J-GLOBAL ID：201407071836562920   Nikkaji number：J3.278.965J

Abediterol

アベジテロール
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： C25H30F2N2O4
Molecular formula furigana： C25-H30-F2-N2-O4
Molecular weight： 460.522
InChI： InChI=1S/C25H30F2N2O4/c26-25(27,18-8-4-3-5-9-18)17-33-15-7-2-1-6-14-28-16-22(31)19-10-12-21(30)24-20(19)11-13-23(32)29-24/h3-5,8-13,22,28,30-31H,1-2,6-7,14-17H2,(H,29,32)/t22-/m0/s1
InChI key： SFYAXIFVXBKRPK-QFIPXVFZSA-N
SMILES： O[C@@H](CNCCCCCCOCC(F)(F)c1ccccc1)c1ccc(O)c2[nH]c(=O)ccc12
Systematic name  (3)：
  • 5-[(R)-2-[6-[(2-フェニル-2,2-ジフルオロエチル)オキシ]ヘキシルアミノ]-1-ヒドロキシエチル]-8-ヒドロキシキノリン-2(1H)-オン
  • 5-[(1R)-2-{[6-(2,2-ジフルオロ-2-フェニルエトキシ)ヘキシル]アミノ}-1-ヒドロキシエチル]-8-ヒドロキシ-1,2-ジヒドロキノリン-2-オン
  • 5-[(1R)-2-{[6-(2,2-difluoro-2-phenylethoxy)hexyl]amino}-1-hydroxyethyl]-8-hydroxy-1,2-dihydroquinolin-2-one
Other name (3)：
  • 5-[(R)-2-[6-[(2-Phenyl-2,2-difluoroethyl)oxy]hexylamino]-1-hydroxyethyl]-8-hydroxyquinoline-2(1H)-one
  • アベジテロール
  • Abediterol
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