U8K
Summary
| Name: | 3-(phenylsulfonylamino)pyridine-2-carboxylic acid |
| Formula: | C12 H10 N2 O4 S |
| Formal charge: | 0 |
| Formula weight: | 278.284 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3-(phenylsulfonylamino)pyridine-2-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C12H10N2O4S/c15-12(16)11-10(7-4-8-13-11)14-19(17,18)9-5-2-1-3-6-9/h1-8,14H,(H,15,16) |
| InChIKey | InChI | 1.03 | HOBWUTFQJLTDSS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ncccc1N[S](=O)(=O)c2ccccc2 |
| SMILES | CACTVS | 3.385 | OC(=O)c1ncccc1N[S](=O)(=O)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)S(=O)(=O)Nc2cccnc2C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)S(=O)(=O)Nc2cccnc2C(=O)O |
