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Concept information

organooxygen compound > ester > sulfuric ester > aryl sulfate > 2-hydroxy-5-nitrophenyl hydrogen sulfate
... > organic aromatic compound > phenols > nitrophenol > mononitrophenol > 4-nitrophenols > 2-hydroxy-5-nitrophenyl hydrogen sulfate

Preferred term

2-hydroxy-5-nitrophenyl hydrogen sulfate  

Type

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

charge

  • 0

formula

  • C6H5NO7S

has_functional_parent

inchi

  • InChI=1S/C6H5NO7S/c8-5-2-1-4(7(9)10)3-6(5)14-15(11,12)13/h1-3,8H,(H,11,12,13)

inchikey

  • XMCCOOONGGUOLA-UHFFFAOYSA-N

mass

  • 235.173

monoisotopicmass

  • 234.97867

smiles

  • C1(=CC=C(C=C1OS(O)(=O)=O)[N+]([O-])=O)O

subset

  • 3_STAR

synonym EXACT

  • 2-hydroxy-5-nitrophenyl hydrogen sulfate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:41733

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