methyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-benzoate

Systemtic Name: methyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-benzoate Openeye Name: methyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-methylsulfanyl-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(methylthio)benzoic acid methyl ester IUPAC Name: methyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-methylsulfanylbenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(methylthio)benzoic acid methyl ester Formula: C16H12ClF3O3S MolecularWeight: 376.77789

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)SC

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)SC

InChI

InChI=1S/C16H12ClF3O3S/c1-22-15(21)11-8-10(4-6-14(11)24-2)23-13-5-3-9(7-12(13)17)16(18,19)20/h3-8H,1-2H3