N-[1-[3-(4-cyclopropylcarbonylphenoxy)propyl]pyrrolidin-1-ium-1-yl]-3-fluoranyl-benzenesulfonamide

Systemtic Name: N-[1-[3-(4-cyclopropylcarbonylphenoxy)propyl]pyrrolidin-1-ium-1-yl]-3-fluoranyl-benzenesulfonamide Openeye Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-3-fluoro-benzenesulfonamide CAS Name: N-[1-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1-pyrrolidin-1-iumyl]-3-fluorobenzenesulfonamide IUPAC Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-3-fluorobenzenesulfonamide Traditional Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-3-fluoro-benzenesulfonamide Formula: C23H28FN2O4S+ MolecularWeight: 447.542823

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CCCOC2=CC=C(C=C2)C(=O)C3CC3)NS(=O)(=O)C4=CC=CC(=C4)F

Isomeric SMILES

C1CC[N+](C1)(CCCOC2=CC=C(C=C2)C(=O)C3CC3)NS(=O)(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C23H28FN2O4S/c24-20-5-3-6-22(17-20)31(28,29)25-26(13-1-2-14-26)15-4-16-30-21-11-9-19(10-12-21)23(27)18-7-8-18/h3,5-6,9-12,17-18,25H,1-2,4,7-8,13-16H2/q+1