N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C19H22F3N2O2S+ MolecularWeight: 399.45039

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=CC=C2CNS(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H21F3N2O2S/c20-19(21,22)17-9-3-4-10-18(17)27(25,26)23-13-15-7-1-2-8-16(15)14-24-11-5-6-12-24/h1-4,7-10,23H,5-6,11-14H2/p+1