10.14272-MIIFHRBUBUHJMC-UHFFFAOYSA-N.1.xml

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<![CDATA[
{
  "@context": "https://schema.org/",
  "@type": "MolecularEntity",
  "dct:conformsTo": {
    "http://purl.org/dc/terms/conformsTo": {
      "@id": "https://bioschemas.org/profiles/MolecularEntity/0.5-RELEASE",
      "@type": "CreativeWork"
    }
  },
  "@id": "10.14272/MIIFHRBUBUHJMC-UHFFFAOYSA-N.1",
  "name": "ethyl 3-oxo-4H-quinoxaline-2-carboxylate",
  "url": "http://chemotion-repository.net/home/publications/molecules/6338",
  "identifier": "chemotion ID ?",
  "iupacName": "ethyl 3-oxo-4H-quinoxaline-2-carboxylate",
  "smiles": "CCOC(=O)c1nc2ccccc2nc1O",
  "inChI": "InChI=1S/C11H10N2O3/c1-2-16-11(15)9-10(14)13-8-6-4-3-5-7(8)12-9/h3-6H,2H2,1H3,(H,13,14)",
  "inChIKey": "MIIFHRBUBUHJMC-UHFFFAOYSA-N",
  "molecularFormula": "C11H10N2O3",
  "molecularWeight": {
    "value": 218.20870000000002
  }
}
]]>
</json>