Chem
J-GLOBAL ID：200907042537053024   Nikkaji number：J1.793.880K

N-[2-[2-[2-[2-(Bromomethyl)-5-[3-(trifluoromethyl)-3H-diazirine-3-yl]phenoxy]ethoxy]ethoxy]ethyl]carbamic acid tert-butyl ester

N-[2-[2-[2-[2-(ブロモメチル)-5-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]フェノキシ]エトキシ]エトキシ]エチル]カルバミド酸tert-ブチル
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： C20H27BrF3N3O5
Molecular formula furigana： C20-H27-BR-F3-N3-O5
Molecular weight： 526.351
InChI： InChI=1S/C20H27BrF3N3O5/c1-18(2,3)32-17(28)25-6-7-29-8-9-30-10-11-31-16-12-15(5-4-14(16)13-21)19(26-27-19)20(22,23)24/h4-5,12H,6-11,13H2,1-3H3,(H,25,28)
InChI key： GJDUKIHRRNJZEA-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)NCCOCCOCCOc1cc(ccc1CBr)C1(N=N1)C(F)(F)F
Systematic name  (3)：
  • N-[2-[2-[2-[2-(ブロモメチル)-5-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]フェノキシ]エトキシ]エトキシ]エチル]カルバミド酸tert-ブチル
  • tert-ブチル N-[2-(2-{2-[2-(ブロモメチル)-5-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]フェノキシ]エトキシ}エトキシ)エチル]カルバマート
  • tert-butyl N-[2-(2-{2-[2-(bromomethyl)-5-[3-(trifluoromethyl)-3H-diazirin-3-yl]phenoxy]ethoxy}ethoxy)ethyl]carbamate
Other name (1)：
  • N-[2-[2-[2-[2-(Bromomethyl)-5-[3-(trifluoromethyl)-3H-diazirine-3-yl]phenoxy]ethoxy]ethoxy]ethyl]carbamic acid tert-butyl ester
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