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

Systemtic Name: 3-[(3-chlorophenyl)methylsulfonyl]-4-fluoranyl-benzoic acid Openeye Name: 3-[(3-chlorophenyl)methylsulfonyl]-4-fluoro-benzoic acid CAS Name: 3-[(3-chlorophenyl)methylsulfonyl]-4-fluorobenzoic acid IUPAC Name: 3-[(3-chlorophenyl)methylsulfonyl]-4-fluorobenzoic acid Traditional Name: 3-(3-chlorobenzyl)sulfonyl-4-fluoro-benzoic acid Formula: C14H10ClFO4S MolecularWeight: 328.743203

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10ClFO4S/c15-11-3-1-2-9(6-11)8-21(19,20)13-7-10(14(17)18)4-5-12(13)16/h1-7H,8H2,(H,17,18)