F2L
Summary
Name: | ~{N}-[2,6-bis(fluoranyl)phenyl]ethanamide |
Formula: | C8 H7 F2 N O |
Formal charge: | 0 |
Formula weight: | 171.144 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-[2,6-bis(fluoranyl)phenyl]ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C8H7F2NO/c1-5(12)11-8-6(9)3-2-4-7(8)10/h2-4H,1H3,(H,11,12) |
InChIKey | InChI | 1.06 | BAFSDKCDEQVQMT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1c(F)cccc1F |
SMILES | CACTVS | 3.385 | CC(=O)Nc1c(F)cccc1F |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1c(cccc1F)F |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1c(cccc1F)F |