2-methylpropyl 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxypropanoate

Systemtic Name: 2-methylpropyl 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Openeye Name: isobutyl 2-[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Traditional Name: 2-[3-(2-bromophenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxypropionic acid isobutyl ester Formula: C23H20BrF3O6 MolecularWeight: 529.30051

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20BrF3O6/c1-12(2)11-30-22(29)13(3)31-14-8-9-15-18(10-14)33-21(23(25,26)27)20(19(15)28)32-17-7-5-4-6-16(17)24/h4-10,12-13H,11H2,1-3H3