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

Systemtic Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Openeye Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide CAS Name: N-[3-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]propyl]benzenesulfonamide IUPAC Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Traditional Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O2S/c1-14-11-15(2)13-18(12-14)10-6-9-17-21(19,20)16-7-4-3-5-8-16/h3-5,7-8,14-15,17H,6,9-13H2,1-2H3/p+1/t14-,15-/m1/s1