EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H11ClN2O3 |
| Net Charge | 0 |
| Average Mass | 314.728 |
| Monoisotopic Mass | 314.04582 |
| SMILES | O=c1c([N+](=O)[O-])c(Cl)c2ccccc2n1Cc1ccccc1 |
| InChI | InChI=1S/C16H11ClN2O3/c17-14-12-8-4-5-9-13(12)18(16(20)15(14)19(21)22)10-11-6-2-1-3-7-11/h1-9H,10H2 |
| InChIKey | LPQZIJMSKXXKMU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-chloro-3-nitro-1-(phenylmethyl)-2-quinolinone (CHEBI:93593) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4046 | LINCS |