EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H12N4O4 |
| Net Charge | 0 |
| Average Mass | 300.274 |
| Monoisotopic Mass | 300.08585 |
| SMILES | NC(=NOC(=O)Cc1ccccc1[N+](=O)[O-])c1cccnc1 |
| InChI | InChI=1S/C14H12N4O4/c15-14(11-5-3-7-16-9-11)17-22-13(19)8-10-4-1-2-6-12(10)18(20)21/h1-7,9H,8H2,(H2,15,17) |
| InChIKey | ZNIFCGNLDPWOHO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(2-nitrophenyl)acetic acid [[amino(3-pyridinyl)methylidene]amino] ester (CHEBI:116148) is a C-nitro compound (CHEBI:35716) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27604 | LINCS |