3-bromanyl-4-[[2-oxidanylidene-2-(propylamino)ethyl]sulfamoyl]benzoic acid

Systemtic Name: 3-bromanyl-4-[[2-oxidanylidene-2-(propylamino)ethyl]sulfamoyl]benzoic acid Openeye Name: 3-bromo-4-[[2-oxo-2-(propylamino)ethyl]sulfamoyl]benzoic acid CAS Name: 3-bromo-4-[[2-oxo-2-(propylamino)ethyl]sulfamoyl]benzoic acid IUPAC Name: 3-bromo-4-[[2-oxo-2-(propylamino)ethyl]sulfamoyl]benzoic acid Traditional Name: 3-bromo-4-[[2-keto-2-(propylamino)ethyl]sulfamoyl]benzoic acid Formula: C12H15BrN2O5S MolecularWeight: 379.2269

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br

Isomeric SMILES

CCCNC(=O)CNS(=O)(=O)C1=C(C=C(C=C1)C(=O)O)Br

InChI

InChI=1S/C12H15BrN2O5S/c1-2-5-14-11(16)7-15-21(19,20)10-4-3-8(12(17)18)6-9(10)13/h3-4,6,15H,2,5,7H2,1H3,(H,14,16)(H,17,18)