A1C1L
Summary
| Name: | 1-(benzenesulfonyl)pyrrolidine |
| Formula: | C10 H13 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 211.281 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 1-(benzenesulfonyl)pyrrolidine |
| OpenEye OEToolkits | 3.1.0.0 | 1-(phenylsulfonyl)pyrrolidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=S(=O)(c1ccccc1)N1CCCC1 |
| InChI | InChI | 1.06 | InChI=1S/C10H13NO2S/c12-14(13,11-8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2 |
| InChIKey | InChI | 1.06 | DSWRVRWIXRRDLN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=[S](=O)(N1CCCC1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | O=[S](=O)(N1CCCC1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)S(=O)(=O)N2CCCC2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)S(=O)(=O)N2CCCC2 |
