HS7
Summary
| Name: | N-oxo-2-(phenylsulfonylamino)ethanamide |
| Synonyms: | N-(2-nitroso-2-oxoethyl)benzenesulfonamide |
| Formula: | C8 H8 N2 O4 S |
| Formal charge: | 0 |
| Formula weight: | 228.225 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-oxo-N~2~-(phenylsulfonyl)glycinamide |
| OpenEye OEToolkits | 1.5.0 | N-oxo-2-(phenylsulfonylamino)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(NCC(=O)N=O)c1ccccc1 |
| SMILES_CANONICAL | CACTVS | 3.341 | O=NC(=O)CN[S](=O)(=O)c1ccccc1 |
| SMILES | CACTVS | 3.341 | O=NC(=O)CN[S](=O)(=O)c1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)S(=O)(=O)NCC(=O)N=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)S(=O)(=O)NCC(=O)N=O |
| InChI | InChI | 1.03 | InChI=1S/C8H8N2O4S/c11-8(10-12)6-9-15(13,14)7-4-2-1-3-5-7/h1-5,9H,6H2 |
| InChIKey | InChI | 1.03 | LBEMJFIVKDOIBO-UHFFFAOYSA-N |
