(phenylmethyl) 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate

Systemtic Name: (phenylmethyl) 2-[3-(2-bromanylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanoate Openeye Name: benzyl 2-[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate CAS Name: 2-[[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(2-bromophenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate Traditional Name: 2-[3-(2-bromophenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetic acid benzyl ester Formula: C25H16BrF3O6 MolecularWeight: 549.29015

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=CC=CC=C4Br

InChI

InChI=1S/C25H16BrF3O6/c26-18-8-4-5-9-19(18)34-23-22(31)17-11-10-16(12-20(17)35-24(23)25(27,28)29)32-14-21(30)33-13-15-6-2-1-3-7-15/h1-12H,13-14H2