3-[3-(dimethylazaniumyl)propylsulfamoyl]benzoate

Systemtic Name: 3-[3-(dimethylazaniumyl)propylsulfamoyl]benzoate Openeye Name: 3-[3-(dimethylammonio)propylsulfamoyl]benzoate CAS Name: 3-[3-(dimethylammonio)propylsulfamoyl]benzoate IUPAC Name: 3-[3-(dimethylazaniumyl)propylsulfamoyl]benzoate Traditional Name: 3-[3-(dimethylammonio)propylsulfamoyl]benzoate Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)[O-]

Isomeric SMILES

C[NH+](C)CCCNS(=O)(=O)C1=CC=CC(=C1)C(=O)[O-]

InChI

InChI=1S/C12H18N2O4S/c1-14(2)8-4-7-13-19(17,18)11-6-3-5-10(9-11)12(15)16/h3,5-6,9,13H,4,7-8H2,1-2H3,(H,15,16)