A1MCC
Summary
| Name: | 6-acetamidopyridine-3-carboxylic acid |
| Formula: | C8 H8 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 180.161 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-acetamidopyridine-3-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C8H8N2O3/c1-5(11)10-7-3-2-6(4-9-7)8(12)13/h2-4H,1H3,(H,12,13)(H,9,10,11) |
| InChIKey | InChI | 1.06 | RXSLHYTZMIUANX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(cn1)C(O)=O |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(cn1)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cn1)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cn1)C(=O)O |
