Chem
J-GLOBAL ID：200907006240112009   Nikkaji number：J2.255.085C

3-Chlorophenylcarbamic acid 8-(4-pyridinyl)-5,7-octadiynyl ester

3-クロロフェニルカルバミド酸8-(4-ピリジニル)-5,7-オクタジイニル
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： C20H17ClN2O2
Molecular formula furigana： C20-H17-CL-N2-O2
Molecular weight： 352.820
InChI： InChI=1S/C20H17ClN2O2/c21-18-9-7-10-19(16-18)23-20(24)25-15-6-4-2-1-3-5-8-17-11-13-22-14-12-17/h7,9-14,16H,2,4,6,15H2,(H,23,24)
InChI key： GNYREFBFBLPDTB-UHFFFAOYSA-N
SMILES： Clc1cccc(NC(=O)OCCCCC#CC#Cc2ccncc2)c1
Systematic name  (4)：
  • 3-クロロフェニルカルバミド酸8-(4-ピリジニル)-5,7-オクタジイニル
  • (m-クロロフェニル)カルバミド酸8-(4-ピリジニル)-5,7-オクタジイニル
  • 8-(ピリジン-4-イル)オクタ-5,7-ジイン-1-イル N-(3-クロロフェニル)カルバマート
  • 8-(pyridin-4-yl)octa-5,7-diyn-1-yl N-(3-chlorophenyl)carbamate
Other name (2)：
  • 3-Chlorophenylcarbamic acid 8-(4-pyridinyl)-5,7-octadiynyl ester
  • (m-Chlorophenyl)carbamic acid 8-(4-pyridinyl)-5,7-octadiynyl ester
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