A1L0U
Summary
| Name: | 2-[(2,6-dimethyl-5-oxidanyl-pyrimidin-4-yl)carbonylamino]ethanoic acid |
| Formula: | C9 H11 N3 O4 |
| Formal charge: | 0 |
| Formula weight: | 225.201 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-[(2,6-dimethyl-5-oxidanyl-pyrimidin-4-yl)carbonylamino]ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H11N3O4/c1-4-8(15)7(12-5(2)11-4)9(16)10-3-6(13)14/h15H,3H2,1-2H3,(H,10,16)(H,13,14) |
| InChIKey | InChI | 1.06 | HXKWBCRFXFVMTI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc(C)c(O)c(n1)C(=O)NCC(O)=O |
| SMILES | CACTVS | 3.385 | Cc1nc(C)c(O)c(n1)C(=O)NCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(c(nc(n1)C)C(=O)NCC(=O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(c(nc(n1)C)C(=O)NCC(=O)O)O |
