N-tert-butyl-2-[4-[3-(dimethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[3-(dimethylsulfamoyl)phenyl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[3-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[[3-(dimethylsulfamoyl)phenyl]-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[3-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[3-(dimethylsulfamoyl)benzoyl]piperazin-1-ium-1-yl]acetamide Formula: C19H31N4O4S+ MolecularWeight: 411.53884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N4O4S/c1-19(2,3)20-17(24)14-22-9-11-23(12-10-22)18(25)15-7-6-8-16(13-15)28(26,27)21(4)5/h6-8,13H,9-12,14H2,1-5H3,(H,20,24)/p+1