A1I27
Summary
| Name: | methyl pyridazine-4-carboxylate |
| Formula: | C6 H6 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 138.124 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | methyl pyridazine-4-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C6H6N2O2/c1-10-6(9)5-2-3-7-8-4-5/h2-4H,1H3 |
| InChIKey | InChI | 1.06 | IJFLWNYKGMQQOW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1ccnnc1 |
| SMILES | CACTVS | 3.385 | COC(=O)c1ccnnc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)c1ccnnc1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)c1ccnnc1 |
