2-fluoranyl-5-methyl-N-[(2S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide

Systemtic Name: 2-fluoranyl-5-methyl-N-[(2S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Openeye Name: 2-fluoro-5-methyl-N-[(2S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide CAS Name: 2-fluoro-5-methyl-N-[(2S)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]benzenesulfonamide IUPAC Name: 2-fluoro-5-methyl-N-[(2S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Traditional Name: 2-fluoro-5-methyl-N-[(2S)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Formula: C16H26FN2O2S+ MolecularWeight: 329.453243

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1C(C)CNS(=O)(=O)C2=C(C=CC(=C2)C)F

Isomeric SMILES

C[C@H]1CCCC[NH+]1[C@@H](C)CNS(=O)(=O)C2=C(C=CC(=C2)C)F

InChI

InChI=1S/C16H25FN2O2S/c1-12-7-8-15(17)16(10-12)22(20,21)18-11-14(3)19-9-5-4-6-13(19)2/h7-8,10,13-14,18H,4-6,9,11H2,1-3H3/p+1/t13-,14-/m0/s1