V8I
Summary
| Name: | 2,4-dichloro-5-sulfamoylbenzoic acid |
| Synonyms: | 2,4-bis(chloranyl)-5-sulfamoyl-benzoic acid |
| Formula: | C7 H5 Cl2 N O4 S |
| Formal charge: | 0 |
| Formula weight: | 270.09 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2,4-bis(chloranyl)-5-sulfamoyl-benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H5Cl2NO4S/c8-4-2-5(9)6(15(10,13)14)1-3(4)7(11)12/h1-2H,(H,11,12)(H2,10,13,14) |
| InChIKey | InChI | 1.06 | ZSHHRBYVHTVRFK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | N[S](=O)(=O)c1cc(C(O)=O)c(Cl)cc1Cl |
| SMILES | CACTVS | 3.385 | N[S](=O)(=O)c1cc(C(O)=O)c(Cl)cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c(c(cc(c1S(=O)(=O)N)Cl)Cl)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c(c(cc(c1S(=O)(=O)N)Cl)Cl)C(=O)O |
