pentyl 2-[3-(4-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate

Systemtic Name: pentyl 2-[3-(4-chlorophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: pentyl 2-[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetic acid pentyl ester IUPAC Name: pentyl 2-[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[3-(4-chlorophenyl)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid amyl ester Formula: C23H20ClF3O5 MolecularWeight: 468.85011

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)COC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCOC(=O)COC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H20ClF3O5/c1-2-3-4-11-30-19(28)13-31-16-9-10-17-18(12-16)32-22(23(25,26)27)20(21(17)29)14-5-7-15(24)8-6-14/h5-10,12H,2-4,11,13H2,1H3