NXE
Summary
| Name: | ~{N}-[3-(trifluoromethyl)-1,2-oxazol-5-yl]ethanamide |
| Formula: | C6 H5 F3 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 194.111 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[3-(trifluoromethyl)-1,2-oxazol-5-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H5F3N2O2/c1-3(12)10-5-2-4(11-13-5)6(7,8)9/h2H,1H3,(H,10,12) |
| InChIKey | InChI | 1.03 | KKHMJANPVRFCAR-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1onc(c1)C(F)(F)F |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1onc(c1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1cc(no1)C(F)(F)F |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1cc(no1)C(F)(F)F |
