5-[(4-bromanyl-2-methoxycarbonyl-phenyl)sulfonylamino]-2,4-bis(fluoranyl)benzoic acid

Systemtic Name: 5-[(4-bromanyl-2-methoxycarbonyl-phenyl)sulfonylamino]-2,4-bis(fluoranyl)benzoic acid Openeye Name: 5-[(4-bromo-2-methoxycarbonyl-phenyl)sulfonylamino]-2,4-difluoro-benzoic acid CAS Name: 5-[(4-bromo-2-methoxycarbonylphenyl)sulfonylamino]-2,4-difluorobenzoic acid IUPAC Name: 5-[(4-bromo-2-methoxycarbonylphenyl)sulfonylamino]-2,4-difluorobenzoic acid Traditional Name: 5-[(4-bromo-2-carbomethoxy-phenyl)sulfonylamino]-2,4-difluoro-benzoic acid Formula: C15H10BrF2NO6S MolecularWeight: 450.208806

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NC2=C(C=C(C(=C2)C(=O)O)F)F

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Br)S(=O)(=O)NC2=C(C=C(C(=C2)C(=O)O)F)F

InChI

InChI=1S/C15H10BrF2NO6S/c1-25-15(22)9-4-7(16)2-3-13(9)26(23,24)19-12-5-8(14(20)21)10(17)6-11(12)18/h2-6,19H,1H3,(H,20,21)