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CHEBI:94171 - 4-[(4-methylphenyl)thio]-3-nitro-1-benzopyran-2-one
| Formula | C16H11NO4S |
| Net Charge | 0 |
| Average Mass | 313.334 |
| Monoisotopic Mass | 313.04088 |
| SMILES | Cc1ccc(Sc2c([N+](=O)[O-])c(=O)oc3ccccc23)cc1 |
| InChI | InChI=1S/C16H11NO4S/c1-10-6-8-11(9-7-10)22-15-12-4-2-3-5-13(12)21-16(18)14(15)17(19)20/h2-9H,1H3 |
| InChIKey | AYTFWRLTLWWBCW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[(4-methylphenyl)thio]-3-nitro-1-benzopyran-2-one (CHEBI:94171) is a coumarins (CHEBI:23403) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4791 | LINCS |