Chem
J-GLOBAL ID：201707011937095656   Nikkaji number：J3.627.011J

[1-(4-Chlorophenyl)-3-cyanopropyl]carbamic acid tert-butyl ester

[1-(4-クロロフェニル)-3-シアノプロピル]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： C15H19ClN2O2
Molecular formula furigana： C15-H19-CL-N2-O2
Molecular weight： 294.780
InChI： InChI=1S/C15H19ClN2O2/c1-15(2,3)20-14(19)18-13(5-4-10-17)11-6-8-12(16)9-7-11/h6-9,13H,4-5H2,1-3H3,(H,18,19)
InChI key： QXYLFKQRMSQZBL-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)NC(CCC#N)c1ccc(Cl)cc1
Systematic name  (3)：
  • [1-(4-クロロフェニル)-3-シアノプロピル]カルバミド酸tert-ブチル
  • tert-ブチル N-[1-(4-クロロフェニル)-3-シアノプロピル]カルバマート
  • tert-butyl N-[1-(4-chlorophenyl)-3-cyanopropyl]carbamate
Other name (1)：
  • [1-(4-Chlorophenyl)-3-cyanopropyl]carbamic acid tert-butyl ester
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