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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CC(C)(C)C)C(F)(F)F

Isomeric SMILES

CCC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CC(C)(C)C)C(F)(F)F

InChI

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