Chem
J-GLOBAL ID：201207000784146087   Nikkaji number：J3.025.556I

1-(4-Chlorophenyl)-3β-(4-cyanophenyl)aziridine-2β-carboxylic acid ethyl ester

1-(4-クロロフェニル)-3β-(4-シアノフェニル)アジリジン-2β-カルボン酸エチル
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： C18H15ClN2O2
Molecular formula furigana： C18-H15-CL-N2-O2
Molecular weight： 326.780
InChI： InChI=1S/C18H15ClN2O2/c1-2-23-18(22)17-16(13-5-3-12(11-20)4-6-13)21(17)15-9-7-14(19)8-10-15/h3-10,16-17H,2H2,1H3/t16-,17-,21?/m1/s1
InChI key： CRSPPFHNUMXKON-LJMNQJIDSA-N
SMILES： CCOC(=O)[C@H]1[C@H](N1c1ccc(Cl)cc1)c1ccc(cc1)C#N
Systematic name  (3)：
  • 1-(4-クロロフェニル)-3β-(4-シアノフェニル)アジリジン-2β-カルボン酸エチル
  • エチル (2R,3R)-1-(4-クロロフェニル)-3-(4-シアノフェニル)アジリジン-2-カルボキシラート
  • ethyl (2R,3R)-1-(4-chlorophenyl)-3-(4-cyanophenyl)aziridine-2-carboxylate
Other name (1)：
  • 1-(4-Chlorophenyl)-3β-(4-cyanophenyl)aziridine-2β-carboxylic acid ethyl ester
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