QS8
Summary
| Name: | [[(3~{R},6~{R})-6-fluoranyl-1-methanoyl-piperidin-3-yl]amino] hydrogen sulfate |
| Formula: | C6 H11 F N2 O5 S |
| Formal charge: | 0 |
| Formula weight: | 242.225 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | [[(3~{R},6~{R})-6-fluoranyl-1-methanoyl-piperidin-3-yl]amino] hydrogen sulfate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H11FN2O5S/c7-6-2-1-5(3-9(6)4-10)8-14-15(11,12)13/h4-6,8H,1-3H2,(H,11,12,13)/t5-,6+/m1/s1 |
| InChIKey | InChI | 1.03 | NHFNUMMVPZGHRV-RITPCOANSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[S](=O)(=O)ON[C@@H]1CC[C@@H](F)N(C1)C=O |
| SMILES | CACTVS | 3.385 | O[S](=O)(=O)ON[CH]1CC[CH](F)N(C1)C=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1C[C@H](N(C[C@@H]1NOS(=O)(=O)O)C=O)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1CC(N(CC1NOS(=O)(=O)O)C=O)F |
