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KJ5

Summary
Name:4-ethyl-2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide
Formula:C8 H7 F4 N O2 S
Formal charge:0
Formula weight:257.205 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.74-ethyl-2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C8H7F4NO2S/c1-2-3-4(9)6(11)8(16(13,14)15)7(12)5(3)10/h2H2,1H3,(H2,13,14,15)
InChIKeyInChI1.03HHQRZAKPYDZJGB-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O
SMILESCACTVS3.385CCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O
SMILES_CANONICALOpenEye OEToolkits2.0.7CCc1c(c(c(c(c1F)F)S(=O)(=O)N)F)F
SMILESOpenEye OEToolkits2.0.7CCc1c(c(c(c(c1F)F)S(=O)(=O)N)F)F

224931

数据于2024-09-11公开中

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