4-fluoranyl-3-methyl-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-3-methyl-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-3-methyl-benzenesulfonamide CAS Name: 4-fluoro-3-methyl-N-[(1-propan-2-yl-4-piperidin-1-iumyl)methyl]benzenesulfonamide IUPAC Name: 4-fluoro-3-methyl-N-[(1-propan-2-ylpiperidin-1-ium-4-yl)methyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[(1-isopropylpiperidin-1-ium-4-yl)methyl]-3-methyl-benzenesulfonamide Formula: C16H26FN2O2S+ MolecularWeight: 329.453243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC2CC[NH+](CC2)C(C)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCC2CC[NH+](CC2)C(C)C)F

InChI

InChI=1S/C16H25FN2O2S/c1-12(2)19-8-6-14(7-9-19)11-18-22(20,21)15-4-5-16(17)13(3)10-15/h4-5,10,12,14,18H,6-9,11H2,1-3H3/p+1