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

Systemtic Name: N-[4-chloranyl-3-(dimethylsulfamoyl)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[4-chloro-3-(dimethylsulfamoyl)phenyl]-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C20H26ClN4O4S+ MolecularWeight: 453.96284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClN4O4S/c1-23(2)30(28,29)19-13-15(3-8-18(19)21)22-20(27)14-24-9-11-25(12-10-24)16-4-6-17(26)7-5-16/h3-8,13,26H,9-12,14H2,1-2H3,(H,22,27)/p+1