Chem
J-GLOBAL ID：200907005341291528   Nikkaji number：J40.896D

AL-294

AL-294
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： C21H25ClO3
Molecular formula furigana： C21-H25-CL-O3
Molecular weight： 360.880
InChI： InChI=1S/C21H25ClO3/c1-4-24-20(23)19(22)14-16-10-12-18(13-11-16)25-15-21(2,3)17-8-6-5-7-9-17/h5-13,19H,4,14-15H2,1-3H3
InChI key： KIZXRDIROMPMKU-UHFFFAOYSA-N
SMILES： CCOC(=O)C(Cl)Cc1ccc(OCC(C)(C)c2ccccc2)cc1
Systematic name  (4)：
  • 2-クロロ-3-[4-(2-メチル-2-フェニルプロピルオキシ)フェニル]プロパン酸エチル
  • α-クロロ-4-(2-メチル-2-フェニルプロポキシ)ベンゼンプロパン酸エチル
  • エチル 2-クロロ-3-[4-(2-メチル-2-フェニルプロポキシ)フェニル]プロパノアート
  • ethyl 2-chloro-3-[4-(2-methyl-2-phenylpropoxy)phenyl]propanoate
Other name (2)：
  • AL-294
  • α-Chloro-4-(2-methyl-2-phenylpropoxy)benzenepropanoic acid ethyl ester
KEGG COMPOUND： C17302
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