A1JEU
Summary
| Name: | methyl 2-[(1~{R})-1-(2,2-dimethylpropanoylamino)-2-oxidanyl-ethyl]-1,3-oxazole-4-carboxylate |
| Formula: | C12 H18 N2 O5 |
| Formal charge: | 0 |
| Formula weight: | 270.282 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | methyl 2-[(1~{R})-1-(2,2-dimethylpropanoylamino)-2-oxidanyl-ethyl]-1,3-oxazole-4-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C12H18N2O5/c1-12(2,3)11(17)14-7(5-15)9-13-8(6-19-9)10(16)18-4/h6-7,15H,5H2,1-4H3,(H,14,17)/t7-/m1/s1 |
| InChIKey | InChI | 1.06 | PHFVLKFIBVHYFY-SSDOTTSWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1coc(n1)[C@@H](CO)NC(=O)C(C)(C)C |
| SMILES | CACTVS | 3.385 | COC(=O)c1coc(n1)[CH](CO)NC(=O)C(C)(C)C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(C)C(=O)N[C@H](CO)c1nc(co1)C(=O)OC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C)C(=O)NC(CO)c1nc(co1)C(=O)OC |
