2-[(3-fluorophenyl)methylsulfonyl]benzoic acid

Systemtic Name: 2-[(3-fluorophenyl)methylsulfonyl]benzoic acid Openeye Name: 2-[(3-fluorophenyl)methylsulfonyl]benzoic acid CAS Name: 2-[(3-fluorophenyl)methylsulfonyl]benzoic acid IUPAC Name: 2-[(3-fluorophenyl)methylsulfonyl]benzoic acid Traditional Name: 2-(3-fluorobenzyl)sulfonylbenzoic acid Formula: C14H11FO4S MolecularWeight: 294.298143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)CC2=CC(=CC=C2)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)CC2=CC(=CC=C2)F

InChI

InChI=1S/C14H11FO4S/c15-11-5-3-4-10(8-11)9-20(18,19)13-7-2-1-6-12(13)14(16)17/h1-8H,9H2,(H,16,17)