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

Systemtic Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]ethanamide Openeye Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide CAS Name: 2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide IUPAC Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide Traditional Name: 2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]-N-[4-methyl-3-(methylsulfamoyl)phenyl]acetamide Formula: C20H27N4O4S+ MolecularWeight: 419.51778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O)S(=O)(=O)NC

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3O)S(=O)(=O)NC

InChI

InChI=1S/C20H26N4O4S/c1-15-7-8-16(13-19(15)29(27,28)21-2)22-20(26)14-23-9-11-24(12-10-23)17-5-3-4-6-18(17)25/h3-8,13,21,25H,9-12,14H2,1-2H3,(H,22,26)/p+1