2,5-bis(fluoranyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide

Systemtic Name: 2,5-bis(fluoranyl)-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide Openeye Name: 2,5-difluoro-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide CAS Name: 2,5-difluoro-N-[[1-(2-methoxyethyl)-4-piperidin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: 2,5-difluoro-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide Traditional Name: 2,5-difluoro-N-[[1-(2-methoxyethyl)piperidin-1-ium-4-yl]methyl]benzenesulfonamide Formula: C15H23F2N2O3S+ MolecularWeight: 349.416526

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCC(CC1)CNS(=O)(=O)C2=C(C=CC(=C2)F)F

Isomeric SMILES

COCC[NH+]1CCC(CC1)CNS(=O)(=O)C2=C(C=CC(=C2)F)F

InChI

InChI=1S/C15H22F2N2O3S/c1-22-9-8-19-6-4-12(5-7-19)11-18-23(20,21)15-10-13(16)2-3-14(15)17/h2-3,10,12,18H,4-9,11H2,1H3/p+1