2-[4-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitrophenyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitrophenyl]piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-[4-[(2,4-dimethylphenyl)sulfamoyl]-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C23H32N5O5S+ MolecularWeight: 490.59568

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H31N5O5S/c1-4-9-24-23(29)16-26-10-12-27(13-11-26)21-8-6-19(15-22(21)28(30)31)34(32,33)25-20-7-5-17(2)14-18(20)3/h5-8,14-15,25H,4,9-13,16H2,1-3H3,(H,24,29)/p+1