EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H17N3O2 |
| Net Charge | 0 |
| Average Mass | 307.353 |
| Monoisotopic Mass | 307.13208 |
| SMILES | COc1ccc(CCNC(=O)c2cnc3ccccc3n2)cc1 |
| InChI | InChI=1S/C18H17N3O2/c1-23-14-8-6-13(7-9-14)10-11-19-18(22)17-12-20-15-4-2-3-5-16(15)21-17/h2-9,12H,10-11H2,1H3,(H,19,22) |
| InChIKey | VBVLKKDCNGYPFY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[2-(4-methoxyphenyl)ethyl]-2-quinoxalinecarboxamide (CHEBI:107688) is a quinoxaline derivative (CHEBI:38771) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19067 | LINCS |