methyl 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]sulfamoyl]benzoate Openeye Name: methyl 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]sulfamoyl]benzoate CAS Name: 2-[[2-(4-methyl-1-piperazin-4-iumyl)phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]sulfamoyl]benzoate Traditional Name: 2-[[2-(4-methylpiperazin-4-ium-1-yl)phenyl]sulfamoyl]benzoic acid methyl ester Formula: C19H24N3O4S+ MolecularWeight: 390.47656

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C19H23N3O4S/c1-21-11-13-22(14-12-21)17-9-5-4-8-16(17)20-27(24,25)18-10-6-3-7-15(18)19(23)26-2/h3-10,20H,11-14H2,1-2H3/p+1