4-chloranyl-N-[1-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methyl-propan-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methyl-propan-2-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[2-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-1,1-dimethyl-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[1-[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]-2-methylpropan-2-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-2-methylpropan-2-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[2-[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]-1,1-dimethyl-ethyl]benzenesulfonamide Formula: C17H28ClN2O2S+ MolecularWeight: 359.93442

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC(C)(C)NS(=O)(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CC(C)(C)NS(=O)(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H27ClN2O2S/c1-13-6-5-7-14(2)20(13)12-17(3,4)19-23(21,22)16-10-8-15(18)9-11-16/h8-11,13-14,19H,5-7,12H2,1-4H3/p+1/t13-,14-/m0/s1