2-[(3-chloranyl-4-fluoranyl-phenyl)sulfanylmethyl]benzoic acid

Systemtic Name: 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfanylmethyl]benzoic acid Openeye Name: 2-[(3-chloro-4-fluoro-phenyl)sulfanylmethyl]benzoic acid CAS Name: 2-[[(3-chloro-4-fluorophenyl)thio]methyl]benzoic acid IUPAC Name: 2-[(3-chloro-4-fluorophenyl)sulfanylmethyl]benzoic acid Traditional Name: 2-[[(3-chloro-4-fluoro-phenyl)thio]methyl]benzoic acid Formula: C14H10ClFO2S MolecularWeight: 296.744403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=CC(=C(C=C2)F)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=CC(=C(C=C2)F)Cl)C(=O)O

InChI

InChI=1S/C14H10ClFO2S/c15-12-7-10(5-6-13(12)16)19-8-9-3-1-2-4-11(9)14(17)18/h1-7H,8H2,(H,17,18)