3-bromanyl-4-[2-(dimethylazaniumyl)ethylsulfamoyl]benzoate

Systemtic Name: 3-bromanyl-4-[2-(dimethylazaniumyl)ethylsulfamoyl]benzoate Openeye Name: 3-bromo-4-[2-(dimethylammonio)ethylsulfamoyl]benzoate CAS Name: 3-bromo-4-[2-(dimethylammonio)ethylsulfamoyl]benzoate IUPAC Name: 3-bromo-4-[2-(dimethylazaniumyl)ethylsulfamoyl]benzoate Traditional Name: 3-bromo-4-[2-(dimethylammonio)ethylsulfamoyl]benzoate Formula: C11H15BrN2O4S MolecularWeight: 351.2168

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNS(=O)(=O)C1=C(C=C(C=C1)C(=O)[O-])Br

Isomeric SMILES

C[NH+](C)CCNS(=O)(=O)C1=C(C=C(C=C1)C(=O)[O-])Br

InChI

InChI=1S/C11H15BrN2O4S/c1-14(2)6-5-13-19(17,18)10-4-3-8(11(15)16)7-9(10)12/h3-4,7,13H,5-6H2,1-2H3,(H,15,16)