GG8

~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide

Created: 2018-09-17
Last modified:  2018-12-26

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Chemical Details

Formal Charge0
Atom Count26
Chiral Atom Count0
Bond Count26
Aromatic Bond Count6
2D diagram of GG8

Chemical Component Summary

Name~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide
Systematic Name (OpenEye OEToolkits)~{N}-[3,3,3-tris(fluoranyl)propyl]benzenesulfonamide
FormulaC9 H10 F3 N O2 S
Molecular Weight253.241
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385FC(F)(F)CCN[S](=O)(=O)c1ccccc1
SMILESOpenEye OEToolkits2.0.6c1ccc(cc1)S(=O)(=O)NCCC(F)(F)F
Canonical SMILESCACTVS3.385 FC(F)(F)CCN[S](=O)(=O)c1ccccc1
Canonical SMILESOpenEye OEToolkits2.0.6 c1ccc(cc1)S(=O)(=O)NCCC(F)(F)F
InChIInChI1.03 InChI=1S/C9H10F3NO2S/c10-9(11,12)6-7-13-16(14,15)8-4-2-1-3-5-8/h1-5,13H,6-7H2
InChIKeyInChI1.03 PCTNYPUVXBXHOS-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 19043657