5-bromanyl-2-[[4-[(3-methoxyphenyl)sulfamoyl]phenyl]carbonylamino]benzoic acid

Systemtic Name: 5-bromanyl-2-[[4-[(3-methoxyphenyl)sulfamoyl]phenyl]carbonylamino]benzoic acid Openeye Name: 5-bromo-2-[[4-[(3-methoxyphenyl)sulfamoyl]benzoyl]amino]benzoic acid CAS Name: 5-bromo-2-[[[4-[(3-methoxyphenyl)sulfamoyl]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 5-bromo-2-[[4-[(3-methoxyphenyl)sulfamoyl]benzoyl]amino]benzoic acid Traditional Name: 5-bromo-2-[[4-[(3-methoxyphenyl)sulfamoyl]benzoyl]amino]benzoic acid Formula: C21H17BrN2O6S MolecularWeight: 505.33848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C21H17BrN2O6S/c1-30-16-4-2-3-15(12-16)24-31(28,29)17-8-5-13(6-9-17)20(25)23-19-10-7-14(22)11-18(19)21(26)27/h2-12,24H,1H3,(H,23,25)(H,26,27)