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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > ethyl 4-(3-oxo-2,3-dihydroisothiazol-2-yl)benzoate

Preferred term

ethyl 4-(3-oxo-2,3-dihydroisothiazol-2-yl)benzoate  

Type

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

Broader concept

charge

  • 0

formula

  • C12H11NO3S

inchi

  • InChI=1S/C12H11NO3S/c1-2-16-12(15)9-3-5-10(6-4-9)13-11(14)7-8-17-13/h3-8H,2H2,1H3

inchikey

  • BZBRYBISKLKJCA-UHFFFAOYSA-N

mass

  • 249.280

monoisotopicmass

  • 249.04596

smiles

  • S1N(C2=CC=C(C=C2)C(OCC)=O)C(=O)C=C1

subset

  • 2_STAR

synonym RELATED

  • 4-(3-Oxo-1,2-thiazol-2(3H)-yl)benzoate d'ethyle
  • ethyl 4-(3-oxo-2(3H)-isothiazolyl)benzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:195296

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