GJE
Summary
| Name: | 4-azido-~{N}-[3,3,3-tris(fluoranyl)propyl]benzamide |
| Formula: | C10 H9 F3 N4 O |
| Formal charge: | 0 |
| Formula weight: | 258.2 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 4-azido-~{N}-[3,3,3-tris(fluoranyl)propyl]benzamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H9F3N4O/c11-10(12,13)5-6-15-9(18)7-1-3-8(4-2-7)16-17-14/h1-4H,5-6H2,(H,15,18) |
| InChIKey | InChI | 1.03 | PCHDVKCHSJFSLZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | FC(F)(F)CCNC(=O)c1ccc(cc1)N=[N+]=[N-] |
| SMILES | CACTVS | 3.385 | FC(F)(F)CCNC(=O)c1ccc(cc1)N=[N+]=[N-] |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C(=O)NCCC(F)(F)F)N=[N+]=[N-] |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1C(=O)NCCC(F)(F)F)N=[N+]=[N-] |
