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 |