methyl 2-(1-butoxy-1-oxidanylidene-propan-2-yl)oxy-4-[2-chloranyl-4-(trifluoromethyl)phenoxy]benzoate

Systemtic Name: methyl 2-(1-butoxy-1-oxidanylidene-propan-2-yl)oxy-4-[2-chloranyl-4-(trifluoromethyl)phenoxy]benzoate Openeye Name: methyl 2-(2-butoxy-1-methyl-2-oxo-ethoxy)-4-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate CAS Name: 2-(1-butoxy-1-oxopropan-2-yl)oxy-4-[2-chloro-4-(trifluoromethyl)phenoxy]benzoic acid methyl ester IUPAC Name: methyl 2-(1-butoxy-1-oxopropan-2-yl)oxy-4-[2-chloro-4-(trifluoromethyl)phenoxy]benzoate Traditional Name: 2-(2-butoxy-2-keto-1-methyl-ethoxy)-4-[2-chloro-4-(trifluoromethyl)phenoxy]benzoic acid methyl ester Formula: C22H22ClF3O6 MolecularWeight: 474.85469

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClF3O6/c1-4-5-10-30-20(27)13(2)31-19-12-15(7-8-16(19)21(28)29-3)32-18-9-6-14(11-17(18)23)22(24,25)26/h6-9,11-13H,4-5,10H2,1-3H3