3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(3-fluoranyl-4-methyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]benzoic acid CAS Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]benzoic acid IUPAC Name: 3-[(3-fluoro-4-methylphenyl)sulfonylamino]benzoic acid Traditional Name: 3-[(3-fluoro-4-methyl-phenyl)sulfonylamino]benzoic acid Formula: C14H12FNO4S MolecularWeight: 309.312783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12FNO4S/c1-9-5-6-12(8-13(9)15)21(19,20)16-11-4-2-3-10(7-11)14(17)18/h2-8,16H,1H3,(H,17,18)