Chem
J-GLOBAL ID：201307079801613274   Nikkaji number：J3.133.125K

E-2012

1-[1-(4-フルオロフェニル)エチル]-3-[(E)-3-メトキシ-4-(4-メチル-1H-イミダゾール-1-イル)ベンジリデン]ピペリジン-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： C25H26FN3O2
Molecular formula furigana： C25-H26-F-N3-O2
Molecular weight： 419.500
InChI： InChI=1S/C25H26FN3O2/c1-17-15-28(16-27-17)23-11-6-19(14-24(23)31-3)13-21-5-4-12-29(25(21)30)18(2)20-7-9-22(26)10-8-20/h6-11,13-16,18H,4-5,12H2,1-3H3/b21-13+
InChI key： PUOAETJYKQITMO-FYJGNVAPSA-N
SMILES： COc1cc(/C=C/2\CCCN(C(C)c3ccc(F)cc3)C2=O)ccc1n1cnc(C)c1
Systematic name  (3)：
  • 1-[1-(4-フルオロフェニル)エチル]-3-[(E)-3-メトキシ-4-(4-メチル-1H-イミダゾール-1-イル)ベンジリデン]ピペリジン-2-オン
  • (3E)-1-[1-(4-フルオロフェニル)エチル]-3-{[3-メトキシ-4-(4-メチル-1H-イミダゾール-1-イル)フェニル]メチリデン}ピペリジン-2-オン
  • (3E)-1-[1-(4-fluorophenyl)ethyl]-3-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]methylidene}piperidin-2-one
Other name (2)：
  • 1-[1-(4-Fluorophenyl)ethyl]-3-[(E)-3-methoxy-4-(4-methyl-1H-imidazole-1-yl)benzylidene]piperidine-2-one
  • E-2012
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