EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H13BrN2O3 |
| Net Charge | 0 |
| Average Mass | 325.162 |
| Monoisotopic Mass | 324.01095 |
| SMILES | CCCc1cc(C(=O)Nc2cc(Br)ccc2O)no1 |
| InChI | InChI=1S/C13H13BrN2O3/c1-2-3-9-7-11(16-19-9)13(18)15-10-6-8(14)4-5-12(10)17/h4-7,17H,2-3H2,1H3,(H,15,18) |
| InChIKey | GCFSBSTUVNHVDX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(5-bromo-2-hydroxyphenyl)-5-propyl-3-isoxazolecarboxamide (CHEBI:105705) is a aromatic amide (CHEBI:62733) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17067 | LINCS |