3,4-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-yl-ethyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[(2S)-2-(4-methyl-1-piperidin-1-iumyl)-2-thiophen-2-ylethyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-thiophen-2-ylethyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[(2S)-2-(4-methylpiperidin-1-ium-1-yl)-2-(2-thienyl)ethyl]benzenesulfonamide Formula: C20H29N2O4S2+ MolecularWeight: 425.58526

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNS(=O)(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CS3

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](CNS(=O)(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CS3

InChI

InChI=1S/C20H28N2O4S2/c1-15-8-10-22(11-9-15)17(20-5-4-12-27-20)14-21-28(23,24)16-6-7-18(25-2)19(13-16)26-3/h4-7,12-13,15,17,21H,8-11,14H2,1-3H3/p+1/t17-/m0/s1