WDL
Summary
| Name: | 1,3,5-triazine-2,4,6-triol |
| Synonyms: | Cyanuric Acid |
| Formula: | C3 H3 N3 O3 |
| Formal charge: | 0 |
| Formula weight: | 129.074 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1,3,5-triazine-2,4,6-triol |
| OpenEye OEToolkits | 1.9.2 | 1,3,5-triazine-2,4,6-triol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1nc(O)nc(O)n1 |
| InChI | InChI | 1.03 | InChI=1S/C3H3N3O3/c7-1-4-2(8)6-3(9)5-1/h(H3,4,5,6,7,8,9) |
| InChIKey | InChI | 1.03 | ZFSLODLOARCGLH-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1nc(O)nc(O)n1 |
| SMILES | CACTVS | 3.385 | Oc1nc(O)nc(O)n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1(nc(nc(n1)O)O)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1(nc(nc(n1)O)O)O |
