2-[(2-fluorophenyl)methylsulfanyl]-5-(trifluoromethyl)benzoic acid

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-(trifluoromethyl)benzoic acid Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-(trifluoromethyl)benzoic acid CAS Name: 2-[(2-fluorophenyl)methylthio]-5-(trifluoromethyl)benzoic acid IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-(trifluoromethyl)benzoic acid Traditional Name: 2-[(2-fluorobenzyl)thio]-5-(trifluoromethyl)benzoic acid Formula: C15H10F4O2S MolecularWeight: 330.297313

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10F4O2S/c16-12-4-2-1-3-9(12)8-22-13-6-5-10(15(17,18)19)7-11(13)14(20)21/h1-7H,8H2,(H,20,21)