A1KTO
Summary
| Name: | (8~{S})-8-oxidanyl-2,6-diazaspiro[3.5]nonan-5-one |
| Formula: | C7 H12 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 156.182 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (8~{S})-8-oxidanyl-2,6-diazaspiro[3.5]nonan-5-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C7H12N2O2/c10-5-1-7(3-8-4-7)6(11)9-2-5/h5,8,10H,1-4H2,(H,9,11)/t5-/m0/s1 |
| InChIKey | InChI | 1.06 | IIRVBVCKAVWMPW-YFKPBYRVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@@H]1CNC(=O)C2(CNC2)C1 |
| SMILES | CACTVS | 3.385 | O[CH]1CNC(=O)C2(CNC2)C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C1[C@@H](CNC(=O)C12CNC2)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | C1C(CNC(=O)C12CNC2)O |
