EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H16ClN3O |
| Net Charge | 0 |
| Average Mass | 301.777 |
| Monoisotopic Mass | 301.09819 |
| SMILES | O=C(c1ccc(Cl)cc1)N1CCN(c2ccccn2)CC1 |
| InChI | InChI=1S/C16H16ClN3O/c17-14-6-4-13(5-7-14)16(21)20-11-9-19(10-12-20)15-3-1-2-8-18-15/h1-8H,9-12H2 |
| InChIKey | HJVFVAZFMFYABI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (4-chlorophenyl)-[4-(2-pyridinyl)-1-piperazinyl]methanone (CHEBI:93205) is a piperazines (CHEBI:26144) |
| (4-chlorophenyl)-[4-(2-pyridinyl)-1-piperazinyl]methanone (CHEBI:93205) is a pyridines (CHEBI:26421) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3535 | LINCS |