O-methyl 4-[2-chloranyl-5-[4-(trifluoromethyl)phenoxy]phenoxy]butanethioate

Systemtic Name: O-methyl 4-[2-chloranyl-5-[4-(trifluoromethyl)phenoxy]phenoxy]butanethioate Openeye Name: O-methyl 4-[2-chloro-5-[4-(trifluoromethyl)phenoxy]phenoxy]butanethioate CAS Name: 4-[2-chloro-5-[4-(trifluoromethyl)phenoxy]phenoxy]butanethioic acid O-methyl ester IUPAC Name: O-methyl 4-[2-chloro-5-[4-(trifluoromethyl)phenoxy]phenoxy]butanethioate Traditional Name: 4-[2-chloro-5-[4-(trifluoromethyl)phenoxy]phenoxy]butanethioic acid O-methyl ester Formula: C18H16ClF3O3S MolecularWeight: 404.83105

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)CCCOC1=C(C=CC(=C1)OC2=CC=C(C=C2)C(F)(F)F)Cl

Isomeric SMILES

COC(=S)CCCOC1=C(C=CC(=C1)OC2=CC=C(C=C2)C(F)(F)F)Cl

InChI

InChI=1S/C18H16ClF3O3S/c1-23-17(26)3-2-10-24-16-11-14(8-9-15(16)19)25-13-6-4-12(5-7-13)18(20,21)22/h4-9,11H,2-3,10H2,1H3