EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H19N3O3 |
| Net Charge | 0 |
| Average Mass | 349.390 |
| Monoisotopic Mass | 349.14264 |
| SMILES | O=C(COc1ccccc1)Nc1nnc(-c2ccc3c(c2)CCCC3)o1 |
| InChI | InChI=1S/C20H19N3O3/c24-18(13-25-17-8-2-1-3-9-17)21-20-23-22-19(26-20)16-11-10-14-6-4-5-7-15(14)12-16/h1-3,8-12H,4-7,13H2,(H,21,23,24) |
| InChIKey | WPPQCGYTXQLEKO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-phenoxy-N-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]acetamide (CHEBI:116275) is a tetralins (CHEBI:36786) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27730 | LINCS |