ethyl 2-[2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[4-(diethylsulfamoyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[4-(diethylsulfamoyl)piperazin-1-ium-1-yl]acetyl]amino]benzoic acid ethyl ester Formula: C19H31N4O5S+ MolecularWeight: 427.53824

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)OCC

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)OCC

InChI

InChI=1S/C19H30N4O5S/c1-4-22(5-2)29(26,27)23-13-11-21(12-14-23)15-18(24)20-17-10-8-7-9-16(17)19(25)28-6-3/h7-10H,4-6,11-15H2,1-3H3,(H,20,24)/p+1