ethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-cyano-phenoxy]butanoate

Systemtic Name: ethyl 2-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-cyano-phenoxy]butanoate Openeye Name: ethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-cyano-phenoxy]butanoate CAS Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-cyanophenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-cyanophenoxy]butanoate Traditional Name: 2-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-cyano-phenoxy]butyric acid ethyl ester Formula: C20H17ClF3NO4 MolecularWeight: 427.80149

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C#N

Isomeric SMILES

CCC(C(=O)OCC)OC1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)C#N

InChI

InChI=1S/C20H17ClF3NO4/c1-3-16(19(26)27-4-2)29-18-10-14(7-5-12(18)11-25)28-17-8-6-13(9-15(17)21)20(22,23)24/h5-10,16H,3-4H2,1-2H3