methyl 3-oxidanylidene-2-propanoyl-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate

Systemtic Name: methyl 3-oxidanylidene-2-propanoyl-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate Openeye Name: methyl 3-oxo-2-propanoyl-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate CAS Name: 3-oxo-2-(1-oxopropyl)-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoic acid methyl ester IUPAC Name: methyl 3-oxo-2-propanoyl-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]pentanoate Traditional Name: 3-keto-2-propionyl-4-[4-[4-(trifluoromethyl)phenoxy]phenoxy]valeric acid methyl ester Formula: C22H21F3O6 MolecularWeight: 438.39375

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21F3O6/c1-4-18(26)19(21(28)29-3)20(27)13(2)30-15-9-11-17(12-10-15)31-16-7-5-14(6-8-16)22(23,24)25/h5-13,19H,4H2,1-3H3