Chem
J-GLOBAL ID：200907074072136598   Nikkaji number：J688.091F

5-(Trifluoromethyl)-1-(4-nitrophenyl)-1H-imidazole-4-carboxylic acid ethyl ester

1-(4-ニトロフェニル)-5-トリフルオロメチル-1H-イミダゾール-4-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： C13H10F3N2[N+]O3[O-]
Molecular formula furigana： C13-H10-F3-N3-O4
Molecular weight： 329.235
InChI： InChI=1S/C13H10F3N3O4/c1-2-23-12(20)10-11(13(14,15)16)18(7-17-10)8-3-5-9(6-4-8)19(21)22/h3-7H,2H2,1H3
InChI key： HKBHFPGORIWTTA-UHFFFAOYSA-N
SMILES： CCOC(=O)c1ncn(c1C(F)(F)F)c1ccc(cc1)[N+](=O)[O-]
Systematic name  (4)：
  • 1-(4-ニトロフェニル)-5-トリフルオロメチル-1H-イミダゾール-4-カルボン酸エチル
  • 5-(トリフルオロメチル)-1-(4-ニトロフェニル)-1H-イミダゾール-4-カルボン酸エチル
  • エチル 1-(4-ニトロフェニル)-5-(トリフルオロメチル)-1H-イミダゾール-4-カルボキシラート
  • ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)-1H-imidazole-4-carboxylate
Other name (1)：
  • 5-(Trifluoromethyl)-1-(4-nitrophenyl)-1H-imidazole-4-carboxylic acid ethyl ester
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