N,N-dimethyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]benzenesulfonamide Openeye Name: N,N-dimethyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]benzenesulfonamide CAS Name: N,N-dimethyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]benzenesulfonamide IUPAC Name: N,N-dimethyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]benzenesulfonamide Traditional Name: N,N-dimethyl-3-[(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)methyl]benzenesulfonamide Formula: C20H25N2O2S+ MolecularWeight: 357.4897

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C[NH+]2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C[NH+]2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2S/c1-21(2)25(23,24)20-10-6-7-17(15-20)16-22-13-11-19(12-14-22)18-8-4-3-5-9-18/h3-11,15H,12-14,16H2,1-2H3/p+1