[3-(3,4-dimethoxyphenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate

Systemtic Name: [3-(3,4-dimethoxyphenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate Openeye Name: [3-(3,4-dimethoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [3-(3,4-dimethoxyphenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(3,4-dimethoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [3-(3,4-dimethoxyphenyl)-4-keto-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H23F3O6 MolecularWeight: 476.44173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4CCCCC4)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4CCCCC4)C(F)(F)F)OC

InChI

InChI=1S/C25H23F3O6/c1-31-18-11-8-15(12-20(18)32-2)21-22(29)17-10-9-16(13-19(17)34-23(21)25(26,27)28)33-24(30)14-6-4-3-5-7-14/h8-14H,3-7H2,1-2H3