Chem
J-GLOBAL ID：200907061849965629   Nikkaji number：J2.698.887J

A-1120

A-1120
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： C20H19F3N2O3
Molecular formula furigana： C20-H19-F3-N2-O3
Molecular weight： 392.378
InChI： InChI=1S/C20H19F3N2O3/c21-20(22,23)16-7-3-1-5-14(16)13-9-11-25(12-10-13)19(28)24-17-8-4-2-6-15(17)18(26)27/h1-8,13H,9-12H2,(H,24,28)(H,26,27)
InChI key： MEAQCLPMSVEOQF-UHFFFAOYSA-N
SMILES： OC(=O)c1ccccc1NC(=O)N1CCC(CC1)c1ccccc1C(F)(F)F
Systematic name  (3)：
  • 2-[[[4-[2-(トリフルオロメチル)フェニル]-1-ピペリジニル]カルボニル]アミノ]安息香酸
  • 2-({4-[2-(トリフルオロメチル)フェニル]ピペリジン-1-カルボニル}アミノ)安息香酸
  • 2-({4-[2-(trifluoromethyl)phenyl]piperidine-1-carbonyl}amino)benzoic acid
Other name (2)：
  • 2-[[[4-[2-(Trifluoromethyl)phenyl]-1-piperidinyl]carbonyl]amino]benzoic acid
  • A-1120
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