Chem
J-GLOBAL ID：200907023415881398   Nikkaji number：J576.550A

2-[4-[3-(3,5-Bis(trifluoromethyl)phenyl)ureido]phenoxy]-2-methylpropionic acid

2-[4-[3-(3,5-ビス(トリフルオロメチル)フェニル)ウレイド]フェノキシ]-2-メチルプロピオン酸
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： C19H16F6N2O4
Molecular formula furigana： C19-H16-F6-N2-O4
Molecular weight： 450.337
InChI： InChI=1S/C19H16F6N2O4/c1-17(2,15(28)29)31-14-5-3-12(4-6-14)26-16(30)27-13-8-10(18(20,21)22)7-11(9-13)19(23,24)25/h3-9H,1-2H3,(H,28,29)(H2,26,27,30)
InChI key： ICSFPMXAPUXUMM-UHFFFAOYSA-N
SMILES： CC(C)(Oc1ccc(NC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1)C(=O)O
Systematic name  (3)：
  • 2-[4-[3-(3,5-ビス(トリフルオロメチル)フェニル)ウレイド]フェノキシ]-2-メチルプロピオン酸
  • 2-[4-({[3,5-ビス(トリフルオロメチル)フェニル]カルバモイル}アミノ)フェノキシ]-2-メチルプロパン酸
  • 2-[4-({[3,5-bis(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-2-methylpropanoic acid
Other name (1)：
  • 2-[4-[3-(3,5-Bis(trifluoromethyl)phenyl)ureido]phenoxy]-2-methylpropionic acid
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