3-fluoranyl-N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide Openeye Name: 3-fluoro-N-[[1-(2-furylmethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide CAS Name: 3-fluoro-N-[[1-(2-furanylmethyl)-4-piperidin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: 3-fluoro-N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide Traditional Name: 3-fluoro-N-[[1-(2-furfuryl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide Formula: C17H22FN2O3S+ MolecularWeight: 353.431583

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CNS(=O)(=O)C2=CC=CC(=C2)F)CC3=CC=CO3

Isomeric SMILES

C1C[NH+](CCC1CNS(=O)(=O)C2=CC=CC(=C2)F)CC3=CC=CO3

InChI

InChI=1S/C17H21FN2O3S/c18-15-3-1-5-17(11-15)24(21,22)19-12-14-6-8-20(9-7-14)13-16-4-2-10-23-16/h1-5,10-11,14,19H,6-9,12-13H2/p+1