Chem
J-GLOBAL ID：200907055217222400   Nikkaji number：J2.236.032I

2,2-Difluoro-3-(benzylamino)-3-(4-chlorophenyl)propionic acid ethyl ester

2,2-ジフルオロ-3-(ベンジルアミノ)-3-(4-クロロフェニル)プロピオン酸エチル
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： C18H18ClF2NO2
Molecular formula furigana： C18-H18-CL-F2-N-O2
Molecular weight： 353.790
InChI： InChI=1S/C18H18ClF2NO2/c1-2-24-17(23)18(20,21)16(14-8-10-15(19)11-9-14)22-12-13-6-4-3-5-7-13/h3-11,16,22H,2,12H2,1H3
InChI key： KJIBEEWTAPXGBY-UHFFFAOYSA-N
SMILES： CCOC(=O)C(F)(F)C(NCc1ccccc1)c1ccc(Cl)cc1
Systematic name  (3)：
  • 2,2-ジフルオロ-3-(ベンジルアミノ)-3-(4-クロロフェニル)プロピオン酸エチル
  • エチル 3-(ベンジルアミノ)-3-(4-クロロフェニル)-2,2-ジフルオロプロパノアート
  • ethyl 3-(benzylamino)-3-(4-chlorophenyl)-2,2-difluoropropanoate
Other name (1)：
  • 2,2-Difluoro-3-(benzylamino)-3-(4-chlorophenyl)propionic acid ethyl ester
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