Chem
J-GLOBAL ID：200907064368451299   Nikkaji number：J1.377.913I

2-Phenyl-3-(4-methoxyanilino)-4,4,4-trifluorobutyric acid methyl ester

2-フェニル-3-(4-メトキシアニリノ)-4,4,4-トリフルオロ酪酸メチル
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： C18H18F3NO3
Molecular formula furigana： C18-H18-F3-N-O3
Molecular weight： 353.341
InChI： InChI=1S/C18H18F3NO3/c1-24-14-10-8-13(9-11-14)22-16(18(19,20)21)15(17(23)25-2)12-6-4-3-5-7-12/h3-11,15-16,22H,1-2H3
InChI key： SZLRCZNMLMGYBT-UHFFFAOYSA-N
SMILES： COC(=O)C(C(Nc1ccc(OC)cc1)C(F)(F)F)c1ccccc1
Systematic name  (3)：
  • 2-フェニル-3-(4-メトキシアニリノ)-4,4,4-トリフルオロ酪酸メチル
  • メチル 4,4,4-トリフルオロ-3-[(4-メトキシフェニル)アミノ]-2-フェニルブタノアート
  • methyl 4,4,4-trifluoro-3-[(4-methoxyphenyl)amino]-2-phenylbutanoate
Other name (1)：
  • 2-Phenyl-3-(4-methoxyanilino)-4,4,4-trifluorobutyric acid methyl ester
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