6DK
Summary
| Name: | 9,9,9-tris(fluoranyl)-8,8-bis(oxidanyl)-~{N}-phenyl-nonanamide |
| Formula: | C15 H20 F3 N O3 |
| Formal charge: | 0 |
| Formula weight: | 319.319 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.5 | 9,9,9-tris(fluoranyl)-8,8-bis(oxidanyl)-~{N}-phenyl-nonanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C15H20F3NO3/c16-15(17,18)14(21,22)11-7-2-1-6-10-13(20)19-12-8-4-3-5-9-12/h3-5,8-9,21-22H,1-2,6-7,10-11H2,(H,19,20) |
| InChIKey | InChI | 1.03 | DOVGAPNVSPZBAT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(O)(CCCCCCC(=O)Nc1ccccc1)C(F)(F)F |
| SMILES | CACTVS | 3.385 | OC(O)(CCCCCCC(=O)Nc1ccccc1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)NC(=O)CCCCCCC(C(F)(F)F)(O)O |
| SMILES | OpenEye OEToolkits | 2.0.5 | c1ccc(cc1)NC(=O)CCCCCCC(C(F)(F)F)(O)O |
