3-chloranyl-5-[[2-(trifluoromethyl)phenyl]methylsulfinyl]benzoic acid

Systemtic Name: 3-chloranyl-5-[[2-(trifluoromethyl)phenyl]methylsulfinyl]benzoic acid Openeye Name: 3-chloro-5-[[2-(trifluoromethyl)phenyl]methylsulfinyl]benzoic acid CAS Name: 3-chloro-5-[[2-(trifluoromethyl)phenyl]methylsulfinyl]benzoic acid IUPAC Name: 3-chloro-5-[[2-(trifluoromethyl)phenyl]methylsulfinyl]benzoic acid Traditional Name: 3-chloro-5-[2-(trifluoromethyl)benzyl]sulfinyl-benzoic acid Formula: C15H10ClF3O3S MolecularWeight: 362.75131

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10ClF3O3S/c16-11-5-10(14(20)21)6-12(7-11)23(22)8-9-3-1-2-4-13(9)15(17,18)19/h1-7H,8H2,(H,20,21)