methyl 4-[7-(2-methylpropanoyloxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]oxybenzoate

Systemtic Name: methyl 4-[7-(2-methylpropanoyloxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Openeye Name: methyl 4-[7-(2-methylpropanoyloxy)-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate CAS Name: 4-[[7-(2-methyl-1-oxopropoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-3-yl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[7-(2-methylpropanoyloxy)-4-oxo-2-(trifluoromethyl)chromen-3-yl]oxybenzoate Traditional Name: 4-[7-isobutyryloxy-4-keto-2-(trifluoromethyl)chromen-3-yl]oxybenzoic acid methyl ester Formula: C22H17F3O7 MolecularWeight: 450.36139

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C)C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H17F3O7/c1-11(2)20(27)31-14-8-9-15-16(10-14)32-19(22(23,24)25)18(17(15)26)30-13-6-4-12(5-7-13)21(28)29-3/h4-11H,1-3H3