EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H19N3O3 |
| Net Charge | 0 |
| Average Mass | 361.401 |
| Monoisotopic Mass | 361.14264 |
| SMILES | COC(=O)c1ccc(C2c3c(C)nnc3C(=O)N2c2ccc(C)cc2)cc1 |
| InChI | InChI=1S/C21H19N3O3/c1-12-4-10-16(11-5-12)24-19(17-13(2)22-23-18(17)20(24)25)14-6-8-15(9-7-14)21(26)27-3/h4-11,19H,1-3H3,(H,22,23) |
| InChIKey | QQXYVCDNGJFOJM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[3-methyl-5-(4-methylphenyl)-6-oxo-2,4-dihydropyrrolo[3,4-c]pyrazol-4-yl]benzoic acid methyl ester (CHEBI:115630) is a benzoate ester (CHEBI:36054) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27087 | LINCS |