[3-(2,5-dimethylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,3-dimethylbutanoate

Systemtic Name: [3-(2,5-dimethylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 3,3-dimethylbutanoate Openeye Name: [3-(2,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [3-(2,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(2,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [3-(2,5-dimethylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H23F3O5 MolecularWeight: 448.43163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CC(C)(C)C)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CC(C)(C)C)C(F)(F)F

InChI

InChI=1S/C24H23F3O5/c1-13-6-7-14(2)17(10-13)31-21-20(29)16-9-8-15(30-19(28)12-23(3,4)5)11-18(16)32-22(21)24(25,26)27/h6-11H,12H2,1-5H3