3-(2-carboxyethylsulfonylamino)-4-fluoranyl-benzoic acid

Systemtic Name: 3-(2-carboxyethylsulfonylamino)-4-fluoranyl-benzoic acid Openeye Name: 3-(2-carboxyethylsulfonylamino)-4-fluoro-benzoic acid CAS Name: 3-(2-carboxyethylsulfonylamino)-4-fluorobenzoic acid IUPAC Name: 3-(2-carboxyethylsulfonylamino)-4-fluorobenzoic acid Traditional Name: 3-(2-carboxyethylsulfonylamino)-4-fluoro-benzoic acid Formula: C10H10FNO6S MolecularWeight: 291.252903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NS(=O)(=O)CCC(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NS(=O)(=O)CCC(=O)O)F

InChI

InChI=1S/C10H10FNO6S/c11-7-2-1-6(10(15)16)5-8(7)12-19(17,18)4-3-9(13)14/h1-2,5,12H,3-4H2,(H,13,14)(H,15,16)