Chem
J-GLOBAL ID：200907053790422488   Nikkaji number：J597.697I

(-)-Halofantrine

(-)-ハロファントリン
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： C26H30Cl2F3NO
Molecular formula furigana： C26-H30-CL2-F3-N-O
Molecular weight： 500.430
InChI： InChI=1S/C26H30Cl2F3NO/c1-3-5-10-32(11-6-4-2)12-9-25(33)23-16-22-21(14-18(27)15-24(22)28)20-13-17(26(29,30)31)7-8-19(20)23/h7-8,13-16,25,33H,3-6,9-12H2,1-2H3/t25-/m0/s1
InChI key： FOHHNHSLJDZUGQ-VWLOTQADSA-N
SMILES： CCCCN(CCCC)CC[C@H](O)c1cc2c(Cl)cc(Cl)cc2c2cc(ccc12)C(F)(F)F
Systematic name  (3)：
  • (αS)-1,3-ジクロロ-α-[2-(ジブチルアミノ)エチル]-6-(トリフルオロメチル)-9-フェナントレンメタノール
  • (1S)-3-(ジブチルアミノ)-1-[1,3-ジクロロ-6-(トリフルオロメチル)フェナントレン-9-イル]プロパン-1-オール
  • (1S)-3-(dibutylamino)-1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]propan-1-ol
Other name (3)：
  • (αS)-1,3-Dichloro-α-[2-(dibutylamino)ethyl]-6-(trifluoromethyl)-9-phenanthrenemethanol
  • (-)-ハロファントリン
  • (-)-Halofantrine
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