EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C11H12N2O3S |
| Net Charge | 0 |
| Average Mass | 252.295 |
| Monoisotopic Mass | 252.05686 |
| SMILES | O=C(C=Cc1ccc([N+](=O)[O-])s1)N1CCCC1 |
| InChI | InChI=1S/C11H12N2O3S/c14-10(12-7-1-2-8-12)5-3-9-4-6-11(17-9)13(15)16/h3-6H,1-2,7-8H2 |
| InChIKey | UDSVOHWDGMFOHN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(5-nitro-2-thiophenyl)-1-(1-pyrrolidinyl)-2-propen-1-one (CHEBI:104939) is a C-nitro compound (CHEBI:35716) |
| 3-(5-nitro-2-thiophenyl)-1-(1-pyrrolidinyl)-2-propen-1-one (CHEBI:104939) is a thiophenes (CHEBI:26961) |
| Manual Xrefs | Databases |
|---|---|
| LSM-16302 | LINCS |