EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H22ClN3O4 |
| Net Charge | 0 |
| Average Mass | 439.899 |
| Monoisotopic Mass | 439.12988 |
| SMILES | O=C(COc1ccc(Cl)cc1)Nc1ccc(N2CCN(C(=O)c3ccco3)CC2)cc1 |
| InChI | InChI=1S/C23H22ClN3O4/c24-17-3-9-20(10-4-17)31-16-22(28)25-18-5-7-19(8-6-18)26-11-13-27(14-12-26)23(29)21-2-1-15-30-21/h1-10,15H,11-14,16H2,(H,25,28) |
| InChIKey | LMEBUDRQJGLULG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(4-chlorophenoxy)-N-[4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]phenyl]acetamide (CHEBI:109611) is a piperazines (CHEBI:26144) |
| Manual Xrefs | Databases |
|---|---|
| LSM-21039 | LINCS |