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CHEBI:228395 - 2-[4-(methylsulfonimidoyl)phenoxy]-5-nitropyridine

ChEBI IDCHEBI:228395
ChEBI Name2-[4-(methylsulfonimidoyl)phenoxy]-5-nitropyridine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H11N3O4S
Net Charge0
Average Mass293.304
Monoisotopic Mass293.04703
SMILESCS(=N)(=O)c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1
InChIInChI=1S/C12H11N3O4S/c1-20(13,18)11-5-3-10(4-6-11)19-12-7-2-9(8-14-12)15(16)17/h2-8,13H,1H3
InChIKeyCEPCEXBIGBAUEQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
2-[4-(methylsulfonimidoyl)phenoxy]-5-nitropyridine (CHEBI:228395) is a aromatic ether (CHEBI:35618)
IUPAC Name 
imino-methyl-[4-(5-nitropyridin-2-yl)oxyphenyl]-oxo-lambda6-sulane
Manual XrefsDatabases
535045ChemSpider