3-fluoranyl-4-methyl-5-(pyridin-3-ylsulfamoyl)benzoic acid

Systemtic Name: 3-fluoranyl-4-methyl-5-(pyridin-3-ylsulfamoyl)benzoic acid Openeye Name: 3-fluoro-4-methyl-5-(3-pyridylsulfamoyl)benzoic acid CAS Name: 3-fluoro-4-methyl-5-(3-pyridinylsulfamoyl)benzoic acid IUPAC Name: 3-fluoro-4-methyl-5-(pyridin-3-ylsulfamoyl)benzoic acid Traditional Name: 3-fluoro-4-methyl-5-(3-pyridylsulfamoyl)benzoic acid Formula: C13H11FN2O4S MolecularWeight: 310.300843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1S(=O)(=O)NC2=CN=CC=C2)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1S(=O)(=O)NC2=CN=CC=C2)C(=O)O)F

InChI

InChI=1S/C13H11FN2O4S/c1-8-11(14)5-9(13(17)18)6-12(8)21(19,20)16-10-3-2-4-15-7-10/h2-7,16H,1H3,(H,17,18)