2,5-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzenesulfonamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,5-dimethyl-benzenesulfonamide CAS Name: 2,5-dimethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]benzenesulfonamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,5-dimethylbenzenesulfonamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,5-dimethyl-benzenesulfonamide Formula: C20H27N2O2S+ MolecularWeight: 359.50558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O2S/c1-16-8-9-17(2)20(14-16)25(23,24)21-19-10-12-22(13-11-19)15-18-6-4-3-5-7-18/h3-9,14,19,21H,10-13,15H2,1-2H3/p+1