EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16N2O2 |
| Net Charge | 0 |
| Average Mass | 280.327 |
| Monoisotopic Mass | 280.12118 |
| SMILES | COc1ccc(-c2noc(CCc3ccccc3)n2)cc1 |
| InChI | InChI=1S/C17H16N2O2/c1-20-15-10-8-14(9-11-15)17-18-16(21-19-17)12-7-13-5-3-2-4-6-13/h2-6,8-11H,7,12H2,1H3 |
| InChIKey | YSXLJBBJOHXUBE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(4-methoxyphenyl)-5-(2-phenylethyl)-1,2,4-oxadiazole (CHEBI:116590) is a oxadiazole (CHEBI:46685) |
| 3-(4-methoxyphenyl)-5-(2-phenylethyl)-1,2,4-oxadiazole (CHEBI:116590) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28045 | LINCS |