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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > thiophenecarboxylic acid > 2-[(1-oxo-3-phenylpropyl)amino]-3-thiophenecarboxylic acid methyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > thiophenecarboxylic acid > 2-[(1-oxo-3-phenylpropyl)amino]-3-thiophenecarboxylic acid methyl ester

Preferred term

2-[(1-oxo-3-phenylpropyl)amino]-3-thiophenecarboxylic acid methyl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C15H15NO3S

inchi

  • InChI=1S/C15H15NO3S/c1-19-15(18)12-9-10-20-14(12)16-13(17)8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3,(H,16,17)

inchikey

  • MTQVMVKSXBFESI-UHFFFAOYSA-N

mass

  • 289.351

monoisotopicmass

  • 289.07726

smiles

  • COC(=O)C1=C(SC=C1)NC(=O)CCC2=CC=CC=C2

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:113098

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