EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H12N2O3 |
| Net Charge | 0 |
| Average Mass | 232.239 |
| Monoisotopic Mass | 232.08479 |
| SMILES | CCCC(=O)Nc1ccc2c(c1)C(=O)NC2=O |
| InChI | InChI=1S/C12H12N2O3/c1-2-3-10(15)13-7-4-5-8-9(6-7)12(17)14-11(8)16/h4-6H,2-3H2,1H3,(H,13,15)(H,14,16,17) |
| InChIKey | HYNFGUHAYZBBCE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(1,3-dioxo-5-isoindolyl)butanamide (CHEBI:105588) is a phthalimides (CHEBI:82851) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16951 | LINCS |