7SF
Summary
| Name: | 4-chloranyl-3-(trifluoromethyl)benzenesulfonic acid |
| Formula: | C7 H4 Cl F3 O3 S |
| Formal charge: | 0 |
| Formula weight: | 260.618 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-chloranyl-3-(trifluoromethyl)benzenesulfonic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H4ClF3O3S/c8-6-2-1-4(15(12,13)14)3-5(6)7(9,10)11/h1-3H,(H,12,13,14) |
| InChIKey | InChI | 1.03 | SUQWINLDJOTVAP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[S](=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F |
| SMILES | CACTVS | 3.385 | O[S](=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1S(=O)(=O)O)C(F)(F)F)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1S(=O)(=O)O)C(F)(F)F)Cl |
