N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[4-(2-hydroxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methoxy-phenyl]-2-[4-(2-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C21H29N4O5S+ MolecularWeight: 449.54376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O5S/c1-23(2)31(28,29)16-8-9-20(30-3)17(14-16)22-21(27)15-24-10-12-25(13-11-24)18-6-4-5-7-19(18)26/h4-9,14,26H,10-13,15H2,1-3H3,(H,22,27)/p+1