4-(fluoranylmethoxy)-3-methylsulfonyl-benzoic acid

Systemtic Name: 4-(fluoranylmethoxy)-3-methylsulfonyl-benzoic acid Openeye Name: 4-(fluoromethoxy)-3-methylsulfonyl-benzoic acid CAS Name: 4-(fluoromethoxy)-3-methylsulfonylbenzoic acid IUPAC Name: 4-(fluoromethoxy)-3-methylsulfonylbenzoic acid Traditional Name: 4-(fluoromethoxy)-3-mesyl-benzoic acid Formula: C9H9FO5S MolecularWeight: 248.228163

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OCF

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OCF

InChI

InChI=1S/C9H9FO5S/c1-16(13,14)8-4-6(9(11)12)2-3-7(8)15-5-10/h2-4H,5H2,1H3,(H,11,12)