8KB
Summary
| Name: | (6~{R})-1,4-oxazepan-6-ol |
| Formula: | C5 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 117.146 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (6~{R})-1,4-oxazepan-6-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H11NO2/c7-5-3-6-1-2-8-4-5/h5-7H,1-4H2/t5-/m1/s1 |
| InChIKey | InChI | 1.03 | AJQUDIYIICBQDR-RXMQYKEDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@@H]1CNCCOC1 |
| SMILES | CACTVS | 3.385 | O[CH]1CNCCOC1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1COC[C@@H](CN1)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | C1COCC(CN1)O |
