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

Systemtic Name: N-[4-methyl-3-(methylsulfamoyl)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanamide Openeye Name: N-[4-methyl-3-(methylsulfamoyl)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide CAS Name: N-[4-methyl-3-(methylsulfamoyl)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide IUPAC Name: N-[4-methyl-3-(methylsulfamoyl)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Traditional Name: N-[4-methyl-3-(methylsulfamoyl)phenyl]-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetamide Formula: C19H24N3O3S+ MolecularWeight: 374.47716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC3=CC=CC=C3C2)S(=O)(=O)NC

InChI

InChI=1S/C19H23N3O3S/c1-14-7-8-17(11-18(14)26(24,25)20-2)21-19(23)13-22-10-9-15-5-3-4-6-16(15)12-22/h3-8,11,20H,9-10,12-13H2,1-2H3,(H,21,23)/p+1