EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H14N2O2 |
| Net Charge | 0 |
| Average Mass | 242.278 |
| Monoisotopic Mass | 242.10553 |
| SMILES | CCN(CC)c1ccc2cc(C#N)c(=O)oc2c1 |
| InChI | InChI=1S/C14H14N2O2/c1-3-16(4-2)12-6-5-10-7-11(9-15)14(17)18-13(10)8-12/h5-8H,3-4H2,1-2H3 |
| InChIKey | LOUYEVRVQGFIFB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-(diethylamino)-2-oxo-1-benzopyran-3-carbonitrile (CHEBI:120788) is a coumarins (CHEBI:23403) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32230 | LINCS |