CHEBI:228769 - ethyl 2-nitro-3-(4-nitrophenyl)acrylate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name ethyl 2-nitro-3-(4-nitrophenyl)acrylate
ChEBI ID CHEBI:228769
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H10N2O6
Net Charge 0
Average Mass 266.209
Monoisotopic Mass 266.05389
InChI InChI=1S/C11H10N2O6/c1-2-19-11(14)10(13(17)18)7-8-3-5-9(6-4-8)12(15)16/h3-7H,2H2,1H3
InChIKey NFBZDSNHBGQYBK-UHFFFAOYSA-N
SMILES O(C(=O)C([N+]([O-])=O)=CC1=CC=C([N+]([O-])=O)C=C1)CC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing ethyl 2-nitro-3-(4-nitrophenyl)acrylate (CHEBI:228769) is a cinnamate ester (CHEBI:36087)
IUPAC Name
ethyl 2-nitro-3-(4-nitrophenyl)prop-2-enoate
Manual Xref Database
2024809 ChemSpider
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