2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide CAS Name: 2-[4-(diethylsulfamoyl)-1-piperazin-1-iumyl]-N-(3-nitrophenyl)acetamide IUPAC Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide Traditional Name: 2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]-N-(3-nitrophenyl)acetamide Formula: C16H26N5O5S+ MolecularWeight: 400.47314

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H25N5O5S/c1-3-19(4-2)27(25,26)20-10-8-18(9-11-20)13-16(22)17-14-6-5-7-15(12-14)21(23)24/h5-7,12H,3-4,8-11,13H2,1-2H3,(H,17,22)/p+1