4-fluoranyl-3-[(4-fluorophenyl)methylsulfonyl]benzoic acid

Systemtic Name: 4-fluoranyl-3-[(4-fluorophenyl)methylsulfonyl]benzoic acid Openeye Name: 4-fluoro-3-[(4-fluorophenyl)methylsulfonyl]benzoic acid CAS Name: 4-fluoro-3-[(4-fluorophenyl)methylsulfonyl]benzoic acid IUPAC Name: 4-fluoro-3-[(4-fluorophenyl)methylsulfonyl]benzoic acid Traditional Name: 4-fluoro-3-(4-fluorobenzyl)sulfonyl-benzoic acid Formula: C14H10F2O4S MolecularWeight: 312.288606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F)F

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F)F

InChI

InChI=1S/C14H10F2O4S/c15-11-4-1-9(2-5-11)8-21(19,20)13-7-10(14(17)18)3-6-12(13)16/h1-7H,8H2,(H,17,18)