EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H13ClN2O3 |
| Net Charge | 0 |
| Average Mass | 328.755 |
| Monoisotopic Mass | 328.06147 |
| SMILES | O=C(Nc1ccccc1)OCc1cc(-c2ccccc2Cl)on1 |
| InChI | InChI=1S/C17H13ClN2O3/c18-15-9-5-4-8-14(15)16-10-13(20-23-16)11-22-17(21)19-12-6-2-1-3-7-12/h1-10H,11H2,(H,19,21) |
| InChIKey | UITGCCIJHSVLSQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-phenylcarbamic acid [5-(2-chlorophenyl)-3-isoxazolyl]methyl ester (CHEBI:121431) is a carbamate ester (CHEBI:23003) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32874 | LINCS |