CHEBI:105572 - N-[3-(3-methylphenoxy)-5-nitrophenyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[3-(3-methylphenoxy)-5-nitrophenyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide
ChEBI ID CHEBI:105572
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H14N6O6
Net Charge 0
Average Mass 398.330
Monoisotopic Mass 398.09748
InChI InChI=1S/C17H14N6O6/c1-11-3-2-4-14(5-11)29-15-7-12(6-13(8-15)22(25)26)19-16(24)9-21-10-18-17(20-21)23(27)28/h2-8,10H,9H2,1H3,(H,19,24)
InChIKey XHOYPAKCFYMKRW-UHFFFAOYSA-N
SMILES CC1=CC(=CC=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CN3C=NC(=N3)[N+](=O)[O-]
ChEBI Ontology
Outgoing N-[3-(3-methylphenoxy)-5-nitrophenyl]-2-(3-nitro-1,2,4-triazol-1-yl)acetamide (CHEBI:105572) is a aromatic ether (CHEBI:35618)
Manual Xref Database
LSM-16935 LINCS
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