3-[[2,4,6-tris(fluoranyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[2,4,6-tris(fluoranyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[(2,4,6-trifluorophenyl)sulfamoyl]benzoic acid CAS Name: 3-[(2,4,6-trifluorophenyl)sulfamoyl]benzoic acid IUPAC Name: 3-[(2,4,6-trifluorophenyl)sulfamoyl]benzoic acid Traditional Name: 3-[(2,4,6-trifluorophenyl)sulfamoyl]benzoic acid Formula: C13H8F3NO4S MolecularWeight: 331.26713

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=C(C=C(C=C2F)F)F)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=C(C=C(C=C2F)F)F)C(=O)O

InChI

InChI=1S/C13H8F3NO4S/c14-8-5-10(15)12(11(16)6-8)17-22(20,21)9-3-1-2-7(4-9)13(18)19/h1-6,17H,(H,18,19)