5-[(2-fluorophenyl)methylsulfonylmethyl]furan-2-carboxylate

Systemtic Name: 5-[(2-fluorophenyl)methylsulfonylmethyl]furan-2-carboxylate Openeye Name: 5-[(2-fluorophenyl)methylsulfonylmethyl]furan-2-carboxylate CAS Name: 5-[(2-fluorophenyl)methylsulfonylmethyl]-2-furancarboxylate IUPAC Name: 5-[(2-fluorophenyl)methylsulfonylmethyl]furan-2-carboxylate Traditional Name: 5-[(2-fluorobenzyl)sulfonylmethyl]-2-furoate Formula: C13H10FO5S- MolecularWeight: 297.278903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CS(=O)(=O)CC2=CC=C(O2)C(=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)CS(=O)(=O)CC2=CC=C(O2)C(=O)[O-])F

InChI

InChI=1S/C13H11FO5S/c14-11-4-2-1-3-9(11)7-20(17,18)8-10-5-6-12(19-10)13(15)16/h1-6H,7-8H2,(H,15,16)/p-1