ethyl 2-[3-(4-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxybutanoate

Systemtic Name: ethyl 2-[3-(4-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxybutanoate Openeye Name: ethyl 2-[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxybutanoate CAS Name: 2-[[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]butanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxybutanoate Traditional Name: 2-[3-(4-chlorophenyl)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxybutyric acid ethyl ester Formula: C22H18ClF3O5 MolecularWeight: 454.82353

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(C(=O)OCC)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H18ClF3O5/c1-3-16(21(28)29-4-2)30-14-9-10-15-17(11-14)31-20(22(24,25)26)18(19(15)27)12-5-7-13(23)8-6-12/h5-11,16H,3-4H2,1-2H3