JBF
Summary
| Name: | 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid |
| Formula: | C15 H9 F N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 284.242 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H9FN2O3/c16-12-7-2-1-6-11(12)14-17-13(18-21-14)9-4-3-5-10(8-9)15(19)20/h1-8H,(H,19,20) |
| InChIKey | InChI | 1.03 | OOUGLTULBSNHNF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cccc(c1)c2noc(n2)c3ccccc3F |
| SMILES | CACTVS | 3.385 | OC(=O)c1cccc(c1)c2noc(n2)c3ccccc3F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)c2nc(no2)c3cccc(c3)C(=O)O)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(c(c1)c2nc(no2)c3cccc(c3)C(=O)O)F |
