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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > naproxcinod
organooxygen compound > carbonyl compound > carboxylic ester > naproxcinod
organooxygen compound > nitrate ester > naproxcinod
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nitrates > nitrate ester > naproxcinod
organic aromatic compound > aromatic ether > alkyloxynaphthalene > methoxynaphthalene > naproxcinod

Preferred term

naproxcinod  

Type

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

Broader concept

charge

  • 0

formula

  • C18H21NO6

has_functional_parent

has_role

inchi

  • InChI=1S/C18H21NO6/c1-13(18(20)24-9-3-4-10-25-19(21)22)14-5-6-16-12-17(23-2)8-7-15(16)11-14/h5-8,11-13H,3-4,9-10H2,1-2H3/t13-/m0/s1

inchikey

  • AKFJWRDCWYYTIG-ZDUSSCGKSA-N

mass

  • 347.36240

monoisotopicmass

  • 347.13689

smiles

  • COc1ccc2cc(ccc2c1)[C@H](C)C(=O)OCCCCO[N+]([O-])=O

subset

  • 3_STAR

synonym EXACT

  • 4-(nitrooxy)butyl (2S)-2-(6-methoxy-2-naphthyl)propanoate

synonym RELATED

  • AZD 3582
  • AZD3582
  • HCT 3012
  • naproxcinod
  • naproxcinodum
  • Naproxen-N-butyl nitrate
  • Nitronaproxen
  • (S)-2-(6-Methoxy-2-naphthyl)propanoic acid 4-nitrooxybutyl ester

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:76254

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