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

Systemtic Name: [3-(2,5-dimethylphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 4-ethoxybenzoate Openeye Name: [3-(2,5-dimethylphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic 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] 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid [3-(2,5-dimethylphenoxy)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C27H21F3O6 MolecularWeight: 498.44725

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=C(C=CC(=C4)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=C(O3)C(F)(F)F)OC4=C(C=CC(=C4)C)C

InChI

InChI=1S/C27H21F3O6/c1-4-33-18-9-7-17(8-10-18)26(32)34-19-11-12-20-22(14-19)36-25(27(28,29)30)24(23(20)31)35-21-13-15(2)5-6-16(21)3/h5-14H,4H2,1-3H3