A1ANE
Summary
| Name: | 5-phenyl-1,3,4-oxadiazol-2-ol |
| Formula: | C8 H6 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 162.145 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-phenyl-1,3,4-oxadiazol-2-ol |
| OpenEye OEToolkits | 2.0.7 | 5-phenyl-1,3,4-oxadiazol-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Oc1nnc(o1)c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C8H6N2O2/c11-8-10-9-7(12-8)6-4-2-1-3-5-6/h1-5H,(H,10,11) |
| InChIKey | InChI | 1.06 | RFJQGIYJJLWZJP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1oc(nn1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | Oc1oc(nn1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2nnc(o2)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2nnc(o2)O |
