methyl 5-bromanyl-2-[(3-methylbutanoylamino)sulfamoyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[(3-methylbutanoylamino)sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[(3-methylbutanoylamino)sulfamoyl]benzoate CAS Name: 5-bromo-2-[[(3-methyl-1-oxobutyl)amino]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[(3-methylbutanoylamino)sulfamoyl]benzoate Traditional Name: 5-bromo-2-[(isovalerylamino)sulfamoyl]benzoic acid methyl ester Formula: C13H17BrN2O5S MolecularWeight: 393.25348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNS(=O)(=O)C1=C(C=C(C=C1)Br)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)NNS(=O)(=O)C1=C(C=C(C=C1)Br)C(=O)OC

InChI

InChI=1S/C13H17BrN2O5S/c1-8(2)6-12(17)15-16-22(19,20)11-5-4-9(14)7-10(11)13(18)21-3/h4-5,7-8,16H,6H2,1-3H3,(H,15,17)