4-fluoranyl-2-[(2-methyl-4-methylsulfonyl-phenyl)amino]benzoic acid

Systemtic Name: 4-fluoranyl-2-[(2-methyl-4-methylsulfonyl-phenyl)amino]benzoic acid Openeye Name: 4-fluoro-2-(2-methyl-4-methylsulfonyl-anilino)benzoic acid CAS Name: 4-fluoro-2-(2-methyl-4-methylsulfonylanilino)benzoic acid IUPAC Name: 4-fluoro-2-(2-methyl-4-methylsulfonylanilino)benzoic acid Traditional Name: 4-fluoro-2-(4-mesyl-2-methyl-anilino)benzoic acid Formula: C15H14FNO4S MolecularWeight: 323.339363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C)NC2=C(C=CC(=C2)F)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)C)NC2=C(C=CC(=C2)F)C(=O)O

InChI

InChI=1S/C15H14FNO4S/c1-9-7-11(22(2,20)21)4-6-13(9)17-14-8-10(16)3-5-12(14)15(18)19/h3-8,17H,1-2H3,(H,18,19)