Chem
J-GLOBAL ID：200907090519296798   Nikkaji number：J2.130.316J

L-000902688

(5R)-5-[(1E,3R)-4,4-ジフルオロ-3-ヒドロキシ-4-フェニル-1-ブテニル]-1-[6-(1H-テトラゾール-5-イル)ヘキシル]ピロリジン-2-オン
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： C21H27F2N5O2
Molecular formula furigana： C21-H27-F2-N5-O2
Molecular weight： 419.477
InChI： InChI=1S/C21H27F2N5O2/c22-21(23,16-8-4-3-5-9-16)18(29)13-11-17-12-14-20(30)28(17)15-7-2-1-6-10-19-24-26-27-25-19/h3-5,8-9,11,13,17-18,29H,1-2,6-7,10,12,14-15H2,(H,24,25,26,27)/b13-11+/t17-,18+/m0/s1
InChI key： WPTLQOYLIXWRNN-SLKVGHROSA-N
SMILES： O[C@H](/C=C/[C@H]1CCC(=O)N1CCCCCCc1nnn[nH]1)C(F)(F)c1ccccc1
Systematic name  (3)：
  • (5R)-5-[(1E,3R)-4,4-ジフルオロ-3-ヒドロキシ-4-フェニル-1-ブテニル]-1-[6-(1H-テトラゾール-5-イル)ヘキシル]ピロリジン-2-オン
  • (5R)-5-[(1E,3R)-4,4-ジフルオロ-3-ヒドロキシ-4-フェニルブタ-1-エン-1-イル]-1-[6-(1H-1,2,3,4-テトラゾール-5-イル)ヘキシル]ピロリジン-2-オン
  • (5R)-5-[(1E,3R)-4,4-difluoro-3-hydroxy-4-phenylbut-1-en-1-yl]-1-[6-(1H-1,2,3,4-tetrazol-5-yl)hexyl]pyrrolidin-2-one
Other name (2)：
  • (5R)-5-[(1E,3R)-4,4-Difluoro-3-hydroxy-4-phenyl-1-butenyl]-1-[6-(1H-tetrazole-5-yl)hexyl]pyrrolidine-2-one
  • L-000902688
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