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

Systemtic Name: 2-methylpropyl 2-[3-(3,4-dimethoxyphenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Openeye Name: isobutyl 2-[3-(3,4-dimethoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(3,4-dimethoxyphenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[3-(3,4-dimethoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Traditional Name: 2-[3-(3,4-dimethoxyphenyl)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxypropionic acid isobutyl ester Formula: C25H25F3O7 MolecularWeight: 494.45701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)COC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H25F3O7/c1-13(2)12-33-24(30)14(3)34-16-7-8-17-19(11-16)35-23(25(26,27)28)21(22(17)29)15-6-9-18(31-4)20(10-15)32-5/h6-11,13-14H,12H2,1-5H3