IEJ
Summary
| Name: | O-TOLUENESULFONAMIDE |
| Formula: | C7 H9 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 171.217 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-methylbenzenesulfonamide |
| OpenEye OEToolkits | 1.7.6 | 2-methylbenzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(=O)(N)c1ccccc1C |
| InChI | InChI | 1.03 | InChI=1S/C7H9NO2S/c1-6-4-2-3-5-7(6)11(8,9)10/h2-5H,1H3,(H2,8,9,10) |
| InChIKey | InChI | 1.03 | YCMLQMDWSXFTIF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccccc1[S](N)(=O)=O |
| SMILES | CACTVS | 3.385 | Cc1ccccc1[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1ccccc1S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1ccccc1S(=O)(=O)N |
