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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

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-[2,6-bis(fluoranyl)phenyl]ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C8H7F2NO/c1-5(12)11-8-6(9)3-2-4-7(8)10/h2-4H,1H3,(H,11,12)
InChIKeyInChI1.06BAFSDKCDEQVQMT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(=O)Nc1c(F)cccc1F
SMILESCACTVS3.385CC(=O)Nc1c(F)cccc1F
SMILES_CANONICALOpenEye OEToolkits2.0.7CC(=O)Nc1c(cccc1F)F
SMILESOpenEye OEToolkits2.0.7CC(=O)Nc1c(cccc1F)F

222926

PDB entries from 2024-07-24

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