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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25FN2O2S/c1-12-10-15(17)7-8-16(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