O-methyl 3-[2-bromanyl-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenyl]propanethioate

Systemtic Name: O-methyl 3-[2-bromanyl-5-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenyl]propanethioate Openeye Name: O-methyl 3-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]propanethioate CAS Name: 3-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]propanethioic acid O-methyl ester IUPAC Name: O-methyl 3-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]propanethioate Traditional Name: 3-[2-bromo-5-[2-chloro-4-(trifluoromethyl)phenoxy]phenyl]propanethioic acid O-methyl ester Formula: C17H13BrClF3O2S MolecularWeight: 453.70113

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)CCC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)Br

Isomeric SMILES

COC(=S)CCC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)Br

InChI

InChI=1S/C17H13BrClF3O2S/c1-23-16(25)7-2-10-8-12(4-5-13(10)18)24-15-6-3-11(9-14(15)19)17(20,21)22/h3-6,8-9H,2,7H2,1H3