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Concept information

organooxygen compound > carbonyl compound > ketone > aromatic ketone > 2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propanoic acid methyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propanoic acid methyl ester

Preferred term

2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propanoic acid methyl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C15H14O3S

inchi

  • InChI=1S/C15H14O3S/c1-10(15(17)18-2)11-5-7-12(8-6-11)14(16)13-4-3-9-19-13/h3-10H,1-2H3

inchikey

  • XJKZZVPYOOIMPE-UHFFFAOYSA-N

mass

  • 274.337

monoisotopicmass

  • 274.06637

smiles

  • CC(C1=CC=C(C=C1)C(=O)C2=CC=CS2)C(=O)OC

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:93807

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