BA5
Summary
| Name: | methyl 4-azanyl-1-oxidanyl-2-oxidanylidene-1,8-naphthyridine-3-carboxylate |
| Synonyms: | XZ462 |
| Formula: | C10 H9 N3 O4 |
| Formal charge: | 0 |
| Formula weight: | 235.196 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | methyl 4-azanyl-1-oxidanyl-2-oxidanylidene-1,8-naphthyridine-3-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H9N3O4/c1-17-10(15)6-7(11)5-3-2-4-12-8(5)13(16)9(6)14/h2-4,16H,11H2,1H3 |
| InChIKey | InChI | 1.03 | DNQZHISFLXUWFF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)C1=C(N)c2cccnc2N(O)C1=O |
| SMILES | CACTVS | 3.385 | COC(=O)C1=C(N)c2cccnc2N(O)C1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COC(=O)C1=C(c2cccnc2N(C1=O)O)N |
| SMILES | OpenEye OEToolkits | 2.0.6 | COC(=O)C1=C(c2cccnc2N(C1=O)O)N |
