2,3,4-tris(fluoranyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 2,3,4-tris(fluoranyl)-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 2,3,4-trifluoro-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 2,3,4-trifluoro-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 2,3,4-trifluoro-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 2,3,4-trifluoro-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C13H18F3N2O2S+ MolecularWeight: 323.35443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNS(=O)(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

C1CC[NH+](C1)CCCNS(=O)(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C13H17F3N2O2S/c14-10-4-5-11(13(16)12(10)15)21(19,20)17-6-3-9-18-7-1-2-8-18/h4-5,17H,1-3,6-9H2/p+1