N,N-diethyl-2-[4-[4-(methylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-[4-(methylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-[4-(methylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[[4-(methylsulfamoyl)phenyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-[4-(methylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-[4-(methylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide Formula: C18H29N4O4S+ MolecularWeight: 397.51226

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)NC

InChI

InChI=1S/C18H28N4O4S/c1-4-21(5-2)17(23)14-20-10-12-22(13-11-20)18(24)15-6-8-16(9-7-15)27(25,26)19-3/h6-9,19H,4-5,10-14H2,1-3H3/p+1