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

Systemtic Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-[4-(4-nitrophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]acetamide Formula: C23H32N5O5S+ MolecularWeight: 490.59568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O5S/c1-4-27(5-2)34(32,33)22-16-19(7-6-18(22)3)24-23(29)17-25-12-14-26(15-13-25)20-8-10-21(11-9-20)28(30)31/h6-11,16H,4-5,12-15,17H2,1-3H3,(H,24,29)/p+1