[3-(3-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-bromanylbenzoate

Systemtic Name: [3-(3-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-bromanylbenzoate Openeye Name: [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(3-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-keto-3-(3-methoxyphenoxy)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H14BrF3O6 MolecularWeight: 535.26357

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)Br)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)Br)C(F)(F)F

InChI

InChI=1S/C24H14BrF3O6/c1-31-15-3-2-4-16(11-15)32-21-20(29)18-10-9-17(12-19(18)34-22(21)24(26,27)28)33-23(30)13-5-7-14(25)8-6-13/h2-12H,1H3