EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H21N3O4 |
| Net Charge | 0 |
| Average Mass | 319.361 |
| Monoisotopic Mass | 319.15321 |
| SMILES | O=C(CON=Cc1cccc([N+](=O)[O-])c1)NC1CCCCCC1 |
| InChI | InChI=1S/C16H21N3O4/c20-16(18-14-7-3-1-2-4-8-14)12-23-17-11-13-6-5-9-15(10-13)19(21)22/h5-6,9-11,14H,1-4,7-8,12H2,(H,18,20) |
| InChIKey | NKQSLIHINGREGE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-cycloheptyl-2-[(3-nitrophenyl)methylideneamino]oxyacetamide (CHEBI:108100) is a C-nitro compound (CHEBI:35716) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19477 | LINCS |