EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H14ClN3O5 |
| Net Charge | 0 |
| Average Mass | 423.812 |
| Monoisotopic Mass | 423.06220 |
| SMILES | O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc2oc(-c3ccccc3Cl)nc2c1 |
| InChI | InChI=1S/C21H14ClN3O5/c22-17-4-2-1-3-16(17)21-24-18-11-13(5-10-19(18)30-21)23-20(26)12-29-15-8-6-14(7-9-15)25(27)28/h1-11H,12H2,(H,23,26) |
| InChIKey | FUGVWRCCVMXWPU-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)acetamide (CHEBI:94052) is a C-nitro compound (CHEBI:35716) |
| N-[2-(2-chlorophenyl)-1,3-benzoxazol-5-yl]-2-(4-nitrophenoxy)acetamide (CHEBI:94052) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4652 | LINCS |