N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-fluoro-benzenesulfonamide CAS Name: N-[3-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]propyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-fluorobenzenesulfonamide Traditional Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]-4-fluoro-benzenesulfonamide Formula: C16H26FN2O2S+ MolecularWeight: 329.453243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCNS(=O)(=O)C2=CC=C(C=C2)F)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CCCNS(=O)(=O)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C16H25FN2O2S/c1-13-10-14(2)12-19(11-13)9-3-8-18-22(20,21)16-6-4-15(17)5-7-16/h4-7,13-14,18H,3,8-12H2,1-2H3/p+1/t13-,14-/m1/s1