Chem
J-GLOBAL ID：200907049404179860   Nikkaji number：J576.548J

2-[4-[3-(3-Cyanophenyl)ureido]phenoxy]-2-methylpropionic acid

2-[4-[3-(3-シアノフェニル)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： C18H17N3O4
Molecular formula furigana： C18-H17-N3-O4
Molecular weight： 339.351
InChI： InChI=1S/C18H17N3O4/c1-18(2,16(22)23)25-15-8-6-13(7-9-15)20-17(24)21-14-5-3-4-12(10-14)11-19/h3-10H,1-2H3,(H,22,23)(H2,20,21,24)
InChI key： XRTVISKTNVSSCI-UHFFFAOYSA-N
SMILES： CC(C)(Oc1ccc(NC(=O)Nc2cccc(c2)C#N)cc1)C(=O)O
Systematic name  (3)：
  • 2-[4-[3-(3-シアノフェニル)ウレイド]フェノキシ]-2-メチルプロピオン酸
  • 2-(4-{[(3-シアノフェニル)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-cyanophenyl)carbamoyl]amino}phenoxy)-2-methylpropanoic acid
Other name (1)：
  • 2-[4-[3-(3-Cyanophenyl)ureido]phenoxy]-2-methylpropionic acid
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