N-(3-methoxypropyl)-2-[4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-methoxypropyl)-2-[4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[4-(isopropylsulfamoyl)-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-(3-methoxypropyl)acetamide CAS Name: N-(3-methoxypropyl)-2-[4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-methoxypropyl)-2-[4-[2-nitro-4-(propan-2-ylsulfamoyl)phenyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[4-(isopropylsulfamoyl)-2-nitro-phenyl]piperazin-1-ium-1-yl]-N-(3-methoxypropyl)acetamide Formula: C19H32N5O6S+ MolecularWeight: 458.55228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)NCCCOC)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)N2CC[NH+](CC2)CC(=O)NCCCOC)[N+](=O)[O-]

InChI

InChI=1S/C19H31N5O6S/c1-15(2)21-31(28,29)16-5-6-17(18(13-16)24(26)27)23-10-8-22(9-11-23)14-19(25)20-7-4-12-30-3/h5-6,13,15,21H,4,7-12,14H2,1-3H3,(H,20,25)/p+1