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CHEBI:53799 - (4-hydroxy-5-iodo-3-nitrophenyl)acetate

ChEBI IDCHEBI:53799
ChEBI Name(4-hydroxy-5-iodo-3-nitrophenyl)acetate
Stars
DefinitionAn acetate derivative carrying a 4-hydroxy-5-iodo-3-nitrophenyl substituent at C-2.
Last Modified25 September 2014
Submitterzjosephs
DownloadsMolfile
FormulaC8H5INO5
Net Charge-1
Average Mass322.034
Monoisotopic Mass321.92179
SMILESO=C([O-])Cc1cc(I)c(O)c([N+](=O)[O-])c1
InChIInChI=1S/C8H6INO5/c9-5-1-4(3-7(11)12)2-6(8(5)13)10(14)15/h1-2,13H,3H2,(H,11,12)/p-1
InChIKeyKPWFDZXSCIFGNO-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
(4-hydroxy-5-iodo-3-nitrophenyl)acetate (CHEBI:53799) is a monocarboxylic acid anion (CHEBI:35757)
(4-hydroxy-5-iodo-3-nitrophenyl)acetate (CHEBI:53799) is conjugate base of (4-hydroxy-3-iodo-5-nitrophenyl)acetic acid (CHEBI:53798)
Incoming Relation(s)
(4-hydroxy-3-iodo-5-nitrophenyl)acetic acid (CHEBI:53798) is conjugate acid of (4-hydroxy-5-iodo-3-nitrophenyl)acetate (CHEBI:53799)
IUPAC Name 
(4-hydroxy-3-iodo-5-nitrophenyl)acetate
Synonyms  Source
nitrohydroxyiodophenylacetateChEBI
2-(4-hydroxy-3-iodo-5-nitrophenyl)acetateChEBI