4-fluoranyl-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfonyl-benzoic acid

Systemtic Name: 4-fluoranyl-3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfonyl-benzoic acid Openeye Name: 4-fluoro-3-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfonyl-benzoic acid CAS Name: 4-fluoro-3-[2-oxo-2-(1-pyrrolidinyl)ethyl]sulfonylbenzoic acid IUPAC Name: 4-fluoro-3-(2-oxo-2-pyrrolidin-1-ylethyl)sulfonylbenzoic acid Traditional Name: 4-fluoro-3-(2-keto-2-pyrrolidino-ethyl)sulfonyl-benzoic acid Formula: C13H14FNO5S MolecularWeight: 315.317363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F

Isomeric SMILES

C1CCN(C1)C(=O)CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F

InChI

InChI=1S/C13H14FNO5S/c14-10-4-3-9(13(17)18)7-11(10)21(19,20)8-12(16)15-5-1-2-6-15/h3-4,7H,1-2,5-6,8H2,(H,17,18)