3-[(3-chloranyl-2-fluoranyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(3-chloranyl-2-fluoranyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 3-[(3-chloro-2-fluoro-phenyl)sulfonylamino]benzoic acid CAS Name: 3-[(3-chloro-2-fluorophenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(3-chloro-2-fluorophenyl)sulfonylamino]benzoic acid Traditional Name: 3-[(3-chloro-2-fluoro-phenyl)sulfonylamino]benzoic acid Formula: C13H9ClFNO4S MolecularWeight: 329.731263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9ClFNO4S/c14-10-5-2-6-11(12(10)15)21(19,20)16-9-4-1-3-8(7-9)13(17)18/h1-7,16H,(H,17,18)