N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-[3-(dimethylsulfamoyl)-4-methoxy-phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C20H26N3O4S+ MolecularWeight: 404.50314

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)OC

Isomeric SMILES

CN(C)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)OC

InChI

InChI=1S/C20H25N3O4S/c1-22(2)28(25,26)19-12-17(8-9-18(19)27-3)21-20(24)14-23-11-10-15-6-4-5-7-16(15)13-23/h4-9,12H,10-11,13-14H2,1-3H3,(H,21,24)/p+1