5-chloranyl-2-(3-fluorophenyl)sulfanyl-benzoic acid

Systemtic Name: 5-chloranyl-2-(3-fluorophenyl)sulfanyl-benzoic acid Openeye Name: 5-chloro-2-(3-fluorophenyl)sulfanyl-benzoic acid CAS Name: 5-chloro-2-[(3-fluorophenyl)thio]benzoic acid IUPAC Name: 5-chloro-2-(3-fluorophenyl)sulfanylbenzoic acid Traditional Name: 5-chloro-2-[(3-fluorophenyl)thio]benzoic acid Formula: C13H8ClFO2S MolecularWeight: 282.717823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)Cl)C(=O)O)F

Isomeric SMILES

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)Cl)C(=O)O)F

InChI

InChI=1S/C13H8ClFO2S/c14-8-4-5-12(11(6-8)13(16)17)18-10-3-1-2-9(15)7-10/h1-7H,(H,16,17)