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

Systemtic Name: 2-[[4-bromanyl-3-[(3-fluorophenyl)sulfamoyl]phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[4-bromo-3-[(3-fluorophenyl)sulfamoyl]benzoyl]amino]benzoic acid CAS Name: 2-[[[4-bromo-3-[(3-fluorophenyl)sulfamoyl]phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[4-bromo-3-[(3-fluorophenyl)sulfamoyl]benzoyl]amino]benzoic acid Traditional Name: 2-[[4-bromo-3-[(3-fluorophenyl)sulfamoyl]benzoyl]amino]benzoic acid Formula: C20H14BrFN2O5S MolecularWeight: 493.302963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=CC(=C(C=C2)Br)S(=O)(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C20H14BrFN2O5S/c21-16-9-8-12(19(25)23-17-7-2-1-6-15(17)20(26)27)10-18(16)30(28,29)24-14-5-3-4-13(22)11-14/h1-11,24H,(H,23,25)(H,26,27)