F6F
Summary
| Name: | 2-{[4-(TRIFLUOROMETHOXY)BENZOYL]AMINO}ETHYL DIHYDROGEN PHOSPHATE |
| Synonyms: | N-(4'-TRIFLUOROMETHOXYBENZOYL)-2-AMINO-1-ETHYLPHOSPHATE, F6 |
| Formula: | C10 H11 F3 N O6 P |
| Formal charge: | 0 |
| Formula weight: | 329.166 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2-({[4-(trifluoromethoxy)phenyl]carbonyl}amino)ethyl dihydrogen phosphate |
| OpenEye OEToolkits | 1.5.0 | 2-[[4-(trifluoromethoxy)phenyl]carbonylamino]ethyl dihydrogen phosphate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | FC(F)(F)Oc1ccc(cc1)C(=O)NCCOP(=O)(O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | O[P](O)(=O)OCCNC(=O)c1ccc(OC(F)(F)F)cc1 |
| SMILES | CACTVS | 3.341 | O[P](O)(=O)OCCNC(=O)c1ccc(OC(F)(F)F)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C(=O)NCCOP(=O)(O)O)OC(F)(F)F |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(ccc1C(=O)NCCOP(=O)(O)O)OC(F)(F)F |
| InChI | InChI | 1.03 | InChI=1S/C10H11F3NO6P/c11-10(12,13)20-8-3-1-7(2-4-8)9(15)14-5-6-19-21(16,17)18/h1-4H,5-6H2,(H,14,15)(H2,16,17,18) |
| InChIKey | InChI | 1.03 | YAHFSBJEYPSDPU-UHFFFAOYSA-N |
