3-bromanyl-4-[methyl(3-methylbutan-2-yl)sulfamoyl]benzoic acid

Systemtic Name: 3-bromanyl-4-[methyl(3-methylbutan-2-yl)sulfamoyl]benzoic acid Openeye Name: 3-bromo-4-[1,2-dimethylpropyl(methyl)sulfamoyl]benzoic acid CAS Name: 3-bromo-4-[methyl(3-methylbutan-2-yl)sulfamoyl]benzoic acid IUPAC Name: 3-bromo-4-[methyl(3-methylbutan-2-yl)sulfamoyl]benzoic acid Traditional Name: 3-bromo-4-[1,2-dimethylpropyl(methyl)sulfamoyl]benzoic acid Formula: C13H18BrNO4S MolecularWeight: 364.25532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)N(C)S(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br

Isomeric SMILES

CC(C)C(C)N(C)S(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br

InChI

InChI=1S/C13H18BrNO4S/c1-8(2)9(3)15(4)20(18,19)12-6-5-10(13(16)17)7-11(12)14/h5-9H,1-4H3,(H,16,17)