EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H15N3O4 |
| Net Charge | 0 |
| Average Mass | 265.269 |
| Monoisotopic Mass | 265.10626 |
| SMILES | CC(C)(C)OC(=O)NN=Cc1cccc([N+](=O)[O-])c1 |
| InChI | InChI=1S/C12H15N3O4/c1-12(2,3)19-11(16)14-13-8-9-5-4-6-10(7-9)15(17)18/h4-8H,1-3H3,(H,14,16) |
| InChIKey | ZHELXCPMQSVBSY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(3-nitrophenyl)methylideneamino]carbamic acid tert-butyl ester (CHEBI:116380) is a C-nitro compound (CHEBI:35716) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27834 | LINCS |