EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:40326 - 5-iodo-2-(oxaloamino)benzoic acid

Default Structure
ChEBI IDCHEBI:40326
ChEBI Name5-iodo-2-(oxaloamino)benzoic acid
Stars
Secondary ChEBI IDsCHEBI:30877, CHEBI:40319
Last Modified17 October 2009
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC9H6INO5
Net Charge0
Average Mass335.053
Monoisotopic Mass334.92907
SMILESO=C(O)C(=O)Nc1ccc(I)cc1C(=O)O
InChIInChI=1S/C9H6INO5/c10-4-1-2-6(5(3-4)8(13)14)11-7(12)9(15)16/h1-3H,(H,11,12)(H,13,14)(H,15,16)
InChIKeySHSWHSQPJKMCPN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-iodo-2-(oxaloamino)benzoic acid (CHEBI:40326) has functional parent 2-(oxaloamino)benzoic acid (CHEBI:44493)
5-iodo-2-(oxaloamino)benzoic acid (CHEBI:40326) is a organoiodine compound (CHEBI:37142)
IUPAC Name 
5-iodo-2-(oxaloamino)benzoic acid
Synonym  Source
5-IODO-2-(OXALYL-AMINO)-BENZOIC ACIDPDBeChem
Manual XrefsDatabases
878PDBeChem
Registry NumbersSources
Beilstein:3340649Beilstein