2-[4-oxidanylidene-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyethanoate

Systemtic Name: 2-[4-oxidanylidene-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyethanoate Openeye Name: 2-[4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyacetate CAS Name: 2-[[4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)-1-benzopyran-7-yl]oxy]acetate IUPAC Name: 2-[4-oxo-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyacetate Traditional Name: 2-[4-keto-2-(trifluoromethyl)-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyacetate Formula: C21H16F3O6- MolecularWeight: 421.34335

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17F3O6/c1-10-6-11(2)12(3)15(7-10)29-19-18(27)14-5-4-13(28-9-17(25)26)8-16(14)30-20(19)21(22,23)24/h4-8H,9H2,1-3H3,(H,25,26)/p-1