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KPQ

Summary
Name:1,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonamide
Formula:C4 H2 F9 N O2 S
Formal charge:0
Formula weight:299.115 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.71,1,2,2,3,3,4,4,4-nonakis(fluoranyl)butane-1-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C4H2F9NO2S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H2,14,15,16)
InChIKeyInChI1.03FUVKFLJWBHVMHX-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385N[S](=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
SMILESCACTVS3.385N[S](=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
SMILES_CANONICALOpenEye OEToolkits2.0.7C(C(C(F)(F)S(=O)(=O)N)(F)F)(C(F)(F)F)(F)F
SMILESOpenEye OEToolkits2.0.7C(C(C(F)(F)S(=O)(=O)N)(F)F)(C(F)(F)F)(F)F

218500

PDB entries from 2024-04-17

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