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

Systemtic Name: 2-[3-(3-methyl-4-propan-2-yl-phenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: 2-[3-(4-isopropyl-3-methyl-phenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-(3-methyl-4-propan-2-ylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetate IUPAC Name: 2-[3-(3-methyl-4-propan-2-ylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[3-(4-isopropyl-3-methyl-phenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetate Formula: C22H18F3O6- MolecularWeight: 435.36993

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19F3O6/c1-11(2)15-6-5-14(8-12(15)3)30-20-19(28)16-7-4-13(29-10-18(26)27)9-17(16)31-21(20)22(23,24)25/h4-9,11H,10H2,1-3H3,(H,26,27)/p-1