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

Systemtic Name: methyl 4-[4-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxidanyl-pentanoate Openeye Name: methyl 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxy-pentanoate CAS Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxypentanoic acid methyl ester IUPAC Name: methyl 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxypentanoate Traditional Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-hydroxy-valeric acid methyl ester Formula: C19H18ClF3O5 MolecularWeight: 418.79143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClF3O5/c1-11(16(24)10-18(25)26-2)27-13-4-6-14(7-5-13)28-17-8-3-12(9-15(17)20)19(21,22)23/h3-9,11,16,24H,10H2,1-2H3