Chem
J-GLOBAL ID：200907032501047758   Nikkaji number：J1.877.669C

4′-[2-Nitro-5-(4-benzylpiperazino)phenoxy]acetophenone

4′-[2-ニトロ-5-(4-ベンジルピペラジノ)フェノキシ]アセトフェノン
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： C25H25N2[N+]O3[O-]
Molecular formula furigana： C25-H25-N3-O4
Molecular weight： 431.492
InChI： InChI=1S/C25H25N3O4/c1-19(29)21-7-10-23(11-8-21)32-25-17-22(9-12-24(25)28(30)31)27-15-13-26(14-16-27)18-20-5-3-2-4-6-20/h2-12,17H,13-16,18H2,1H3
InChI key： AJXRULOPBDOASR-UHFFFAOYSA-N
SMILES： CC(=O)c1ccc(Oc2cc(ccc2[N+](=O)[O-])N2CCN(Cc3ccccc3)CC2)cc1
Systematic name  (3)：
  • 4′-[2-ニトロ-5-(4-ベンジルピペラジノ)フェノキシ]アセトフェノン
  • 1-{4-[5-(4-ベンジルピペラジン-1-イル)-2-ニトロフェノキシ]フェニル}エタン-1-オン
  • 1-{4-[5-(4-benzylpiperazin-1-yl)-2-nitrophenoxy]phenyl}ethan-1-one
Other name (1)：
  • 4′-[2-Nitro-5-(4-benzylpiperazino)phenoxy]acetophenone
Thsaurus map：
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