A1BFU
Summary
| Name: | 1-(3-methoxyazetidine-1-sulfonyl)pyrrolidine |
| Formula: | C8 H16 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 220.289 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 1-(3-methoxyazetidine-1-sulfonyl)pyrrolidine |
| OpenEye OEToolkits | 3.1.0.0 | 1-(3-methoxyazetidin-1-yl)sulfonylpyrrolidine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=S(=O)(N1CC(OC)C1)N1CCCC1 |
| InChI | InChI | 1.06 | InChI=1S/C8H16N2O3S/c1-13-8-6-10(7-8)14(11,12)9-4-2-3-5-9/h8H,2-7H2,1H3 |
| InChIKey | InChI | 1.06 | KONUKKZPOYOKNK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC1CN(C1)[S](=O)(=O)N2CCCC2 |
| SMILES | CACTVS | 3.385 | COC1CN(C1)[S](=O)(=O)N2CCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | COC1CN(C1)S(=O)(=O)N2CCCC2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | COC1CN(C1)S(=O)(=O)N2CCCC2 |
