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Concept information

organooxygen compound > carbonyl compound > ketone > aromatic ketone > 2-chloro-3-pyridinecarboxylic acid [2-(4-ethylphenyl)-2-oxoethyl] ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 2-chloro-3-pyridinecarboxylic acid [2-(4-ethylphenyl)-2-oxoethyl] ester

Preferred term

2-chloro-3-pyridinecarboxylic acid [2-(4-ethylphenyl)-2-oxoethyl] ester  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C16H14ClNO3

inchi

  • InChI=1S/C16H14ClNO3/c1-2-11-5-7-12(8-6-11)14(19)10-21-16(20)13-4-3-9-18-15(13)17/h3-9H,2,10H2,1H3

inchikey

  • WIHTVZXBANYSJS-UHFFFAOYSA-N

mass

  • 303.741

monoisotopicmass

  • 303.06622

smiles

  • CCC1=CC=C(C=C1)C(=O)COC(=O)C2=C(N=CC=C2)Cl

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:115513

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