4-fluoranyl-5-[2-[4-[(3-methylpyridin-2-yl)sulfamoyl]phenyl]ethynyl]-2-oxidanyl-benzoic acid

Systemtic Name: 4-fluoranyl-5-[2-[4-[(3-methylpyridin-2-yl)sulfamoyl]phenyl]ethynyl]-2-oxidanyl-benzoic acid Openeye Name: 4-fluoro-2-hydroxy-5-[2-[4-[(3-methyl-2-pyridyl)sulfamoyl]phenyl]ethynyl]benzoic acid CAS Name: 4-fluoro-2-hydroxy-5-[2-[4-[(3-methyl-2-pyridinyl)sulfamoyl]phenyl]ethynyl]benzoic acid IUPAC Name: 4-fluoro-2-hydroxy-5-[2-[4-[(3-methylpyridin-2-yl)sulfamoyl]phenyl]ethynyl]benzoic acid Traditional Name: 4-fluoro-2-hydroxy-5-[2-[4-[(3-methyl-2-pyridyl)sulfamoyl]phenyl]ethynyl]benzoic acid Formula: C21H15FN2O5S MolecularWeight: 426.417603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C#CC3=CC(=C(C=C3F)O)C(=O)O

Isomeric SMILES

CC1=C(N=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C#CC3=CC(=C(C=C3F)O)C(=O)O

InChI

InChI=1S/C21H15FN2O5S/c1-13-3-2-10-23-20(13)24-30(28,29)16-8-5-14(6-9-16)4-7-15-11-17(21(26)27)19(25)12-18(15)22/h2-3,5-6,8-12,25H,1H3,(H,23,24)(H,26,27)