2-[3-[4-(2-methylbutan-2-yl)phenoxy]-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate

Systemtic Name: 2-[3-[4-(2-methylbutan-2-yl)phenoxy]-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: 2-[3-[4-(1,1-dimethylpropyl)phenoxy]-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-[4-(2-methylbutan-2-yl)phenoxy]-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetate IUPAC Name: 2-[3-[4-(2-methylbutan-2-yl)phenoxy]-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[3-(4-tert-amylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetate Formula: C23H20F3O6- MolecularWeight: 449.39651

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)[O-])C(F)(F)F

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)[O-])C(F)(F)F

InChI

InChI=1S/C23H21F3O6/c1-4-22(2,3)13-5-7-14(8-6-13)31-20-19(29)16-10-9-15(30-12-18(27)28)11-17(16)32-21(20)23(24,25)26/h5-11H,4,12H2,1-3H3,(H,27,28)/p-1