[3-(4-methoxyphenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [3-(4-methoxyphenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [3-(4-methoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-(4-methoxyphenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-methoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [4-keto-3-(4-methoxyphenyl)-2-(trifluoromethyl)chromen-7-yl] ester Formula: C25H15F3O7 MolecularWeight: 484.37761

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC5=C(C=C4)OCO5)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC5=C(C=C4)OCO5)C(F)(F)F

InChI

InChI=1S/C25H15F3O7/c1-31-15-5-2-13(3-6-15)21-22(29)17-8-7-16(11-19(17)35-23(21)25(26,27)28)34-24(30)14-4-9-18-20(10-14)33-12-32-18/h2-11H,12H2,1H3