2-[3-(2-tert-butyl-5-methyl-phenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate

Systemtic Name: 2-[3-(2-tert-butyl-5-methyl-phenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: 2-[3-(2-tert-butyl-5-methyl-phenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-(2-tert-butyl-5-methylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetate IUPAC Name: 2-[3-(2-tert-butyl-5-methylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[3-(2-tert-butyl-5-methyl-phenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetate Formula: C23H20F3O6- MolecularWeight: 449.39651

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)[O-])C(F)(F)F

InChI

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