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

Systemtic Name: 2,5-dimethoxy-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]benzenesulfonamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,5-dimethoxy-benzenesulfonamide CAS Name: 2,5-dimethoxy-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]benzenesulfonamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,5-dimethoxybenzenesulfonamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,5-dimethoxy-benzenesulfonamide Formula: C20H27N2O4S+ MolecularWeight: 391.50438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2O4S/c1-25-18-8-9-19(26-2)20(14-18)27(23,24)21-17-10-12-22(13-11-17)15-16-6-4-3-5-7-16/h3-9,14,17,21H,10-13,15H2,1-2H3/p+1