2-[4-oxidanylidene-3-(4-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-7-yl]oxyethanoic acid

Systemtic Name: 2-[4-oxidanylidene-3-(4-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-7-yl]oxyethanoic acid Openeye Name: 2-[3-(4-isopropylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid CAS Name: 2-[[4-oxo-3-(4-propan-2-ylphenoxy)-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetic acid IUPAC Name: 2-[4-oxo-3-(4-propan-2-ylphenoxy)-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid Traditional Name: 2-[3-(4-isopropylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid Formula: C21H17F3O6 MolecularWeight: 422.35129

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC(=O)O)C(F)(F)F

Isomeric SMILES

CC(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/C21H17F3O6/c1-11(2)12-3-5-13(6-4-12)29-19-18(27)15-8-7-14(28-10-17(25)26)9-16(15)30-20(19)21(22,23)24/h3-9,11H,10H2,1-2H3,(H,25,26)