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

Systemtic Name: ethyl 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxybutanoate Openeye Name: ethyl 2-[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxybutanoate CAS Name: 2-[[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]butanoic acid ethyl ester IUPAC Name: ethyl 2-[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxybutanoate Traditional Name: 2-[3-(2-bromophenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxybutyric acid ethyl ester Formula: C22H18BrF3O6 MolecularWeight: 515.27393

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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)OC3=CC=CC=C3Br

Isomeric SMILES

CCC(C(=O)OCC)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=CC=C3Br

InChI

InChI=1S/C22H18BrF3O6/c1-3-15(21(28)29-4-2)30-12-9-10-13-17(11-12)32-20(22(24,25)26)19(18(13)27)31-16-8-6-5-7-14(16)23/h5-11,15H,3-4H2,1-2H3