5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-propylsulfanyl-benzoic acid

Systemtic Name: 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-propylsulfanyl-benzoic acid Openeye Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-propylsulfanyl-benzoic acid CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(propylthio)benzoic acid IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-propylsulfanylbenzoic acid Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(propylthio)benzoic acid Formula: C17H14ClF3O3S MolecularWeight: 390.80447

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C(=O)O

Isomeric SMILES

CCCSC1=C(C=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C(=O)O

InChI

InChI=1S/C17H14ClF3O3S/c1-2-7-25-15-6-4-11(9-12(15)16(22)23)24-14-5-3-10(8-13(14)18)17(19,20)21/h3-6,8-9H,2,7H2,1H3,(H,22,23)