ethyl 4-[4-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxidanyl-pentanoate

Systemtic Name: ethyl 4-[4-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxidanyl-pentanoate Openeye Name: ethyl 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxy-pentanoate CAS Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxypentanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxypentanoate Traditional Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxy-valeric acid ethyl ester Formula: C20H20ClF3O5 MolecularWeight: 432.81801

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)O

Isomeric SMILES

CCOC(=O)CC(C(C)OC1=CC=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)O

InChI

InChI=1S/C20H20ClF3O5/c1-3-27-19(26)11-17(25)12(2)28-14-5-7-15(8-6-14)29-18-9-4-13(10-16(18)21)20(22,23)24/h4-10,12,17,25H,3,11H2,1-2H3