3-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[(2-bromo-4,6-difluoro-phenyl)sulfonylamino]benzoic acid CAS Name: 3-[(2-bromo-4,6-difluorophenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(2-bromo-4,6-difluorophenyl)sulfonylamino]benzoic acid Traditional Name: 3-[(2-bromo-4,6-difluoro-phenyl)sulfonylamino]benzoic acid Formula: C13H8BrF2NO4S MolecularWeight: 392.172726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=C(C=C(C=C2Br)F)F)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=C(C=C(C=C2Br)F)F)C(=O)O

InChI

InChI=1S/C13H8BrF2NO4S/c14-10-5-8(15)6-11(16)12(10)22(20,21)17-9-3-1-2-7(4-9)13(18)19/h1-6,17H,(H,18,19)