Chem
J-GLOBAL ID：201207023958560260   Nikkaji number：J3.081.928D

3-(Trifluoromethyl)-4-(3,3-diisopropyltriazene-1-yl)benzoic acid ethyl ester

3-(トリフルオロメチル)-4-(3,3-ジイソプロピルトリアゼン-1-イル)安息香酸エチル
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： C16H22F3N3O2
Molecular formula furigana： C16-H22-F3-N3-O2
Molecular weight： 345.366
InChI： InChI=1S/C16H22F3N3O2/c1-6-24-15(23)12-7-8-14(13(9-12)16(17,18)19)20-21-22(10(2)3)11(4)5/h7-11H,6H2,1-5H3
InChI key： GUVBZGBNNQJRGH-UHFFFAOYSA-N
SMILES： CCOC(=O)c1ccc(N=NN(C(C)C)C(C)C)c(c1)C(F)(F)F
Systematic name  (3)：
  • 3-(トリフルオロメチル)-4-(3,3-ジイソプロピルトリアゼン-1-イル)安息香酸エチル
  • エチル 4-[3,3-ビス(プロパン-2-イル)トリアザ-1-エン-1-イル]-3-(トリフルオロメチル)ベンゾアート
  • ethyl 4-[3,3-bis(propan-2-yl)triaz-1-en-1-yl]-3-(trifluoromethyl)benzoate
Other name (1)：
  • 3-(Trifluoromethyl)-4-(3,3-diisopropyltriazene-1-yl)benzoic acid ethyl ester
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