[3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-ethylbutanoate

Systemtic Name: [3-(4-chloranyl-3,5-dimethyl-phenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 2-ethylbutanoate Openeye Name: [3-(4-chloro-3,5-dimethyl-phenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-ethylbutanoate CAS Name: 2-ethylbutanoic acid [3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chloro-3,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 2-ethylbutanoate Traditional Name: 2-ethylbutyric acid [3-(4-chloro-3,5-dimethyl-phenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C24H22ClF3O5 MolecularWeight: 482.87669

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=C(C(=C3)C)Cl)C

Isomeric SMILES

CCC(CC)C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC(=C(C(=C3)C)Cl)C

InChI

InChI=1S/C24H22ClF3O5/c1-5-14(6-2)23(30)32-15-7-8-17-18(11-15)33-22(24(26,27)28)21(20(17)29)31-16-9-12(3)19(25)13(4)10-16/h7-11,14H,5-6H2,1-4H3