EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H20N2O4 |
| Net Charge | 0 |
| Average Mass | 340.379 |
| Monoisotopic Mass | 340.14231 |
| SMILES | O=C(Nc1ccc2c(c1)OCO2)c1ccc(CN2CCOCC2)cc1 |
| InChI | InChI=1S/C19H20N2O4/c22-19(20-16-5-6-17-18(11-16)25-13-24-17)15-3-1-14(2-4-15)12-21-7-9-23-10-8-21/h1-6,11H,7-10,12-13H2,(H,20,22) |
| InChIKey | PUOGDXPWFUYYGN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1,3-benzodioxol-5-yl)-4-(4-morpholinylmethyl)benzamide (CHEBI:113089) is a benzodioxoles (CHEBI:38298) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24499 | LINCS |