F4Z
Summary
Name: | 3,5,6-trichloro-2-pyridinol |
Formula: | C5 H2 Cl3 N O |
Formal charge: | 0 |
Formula weight: | 198.434 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 3,5,6-tris(chloranyl)pyridin-2-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10) |
InChIKey | InChI | 1.03 | WCYYAQFQZQEUEN-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1nc(Cl)c(Cl)cc1Cl |
SMILES | CACTVS | 3.385 | Oc1nc(Cl)c(Cl)cc1Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c(c(nc(c1Cl)Cl)O)Cl |
SMILES | OpenEye OEToolkits | 2.0.6 | c1c(c(nc(c1Cl)Cl)O)Cl |