EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H16N2O4 |
| Net Charge | 0 |
| Average Mass | 300.314 |
| Monoisotopic Mass | 300.11101 |
| SMILES | O=C(c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCCCC1 |
| InChI | InChI=1S/C16H16N2O4/c19-16(17-10-2-1-3-11-17)15-9-8-14(22-15)12-4-6-13(7-5-12)18(20)21/h4-9H,1-3,10-11H2 |
| InChIKey | PSBGZWFDRJNMOX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [5-(4-nitrophenyl)-2-furanyl]-(1-piperidinyl)methanone (CHEBI:114392) is a N-acylpiperidine (CHEBI:48591) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25852 | LINCS |