EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H18N2O2 |
| Net Charge | 0 |
| Average Mass | 294.354 |
| Monoisotopic Mass | 294.13683 |
| SMILES | COc1ccc2nc(=O)c(CNc3cccc(C)c3)cc2c1 |
| InChI | InChI=1S/C18H18N2O2/c1-12-4-3-5-15(8-12)19-11-14-9-13-10-16(22-2)6-7-17(13)20-18(14)21/h3-10,19H,11H2,1-2H3,(H,20,21) |
| InChIKey | JHPWKJXYSKRTOZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-methoxy-3-[(3-methylanilino)methyl]-1H-quinolin-2-one (CHEBI:116378) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27832 | LINCS |