methyl 2-[3-(1,3-benzodioxol-5-yl)-4-oxidanylidene-6-propyl-2-(trifluoromethyl)chromen-7-yl]oxypropanoate

Systemtic Name: methyl 2-[3-(1,3-benzodioxol-5-yl)-4-oxidanylidene-6-propyl-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Openeye Name: methyl 2-[3-(1,3-benzodioxol-5-yl)-4-oxo-6-propyl-2-(trifluoromethyl)chromen-7-yl]oxypropanoate CAS Name: 2-[[3-(1,3-benzodioxol-5-yl)-4-oxo-6-propyl-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(1,3-benzodioxol-5-yl)-4-oxo-6-propyl-2-(trifluoromethyl)chromen-7-yl]oxypropanoate Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-4-keto-6-propyl-2-(trifluoromethyl)chromen-7-yl]oxypropionic acid methyl ester Formula: C24H21F3O7 MolecularWeight: 478.41455

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)OC(C)C(=O)OC

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC4=C(C=C3)OCO4)OC(C)C(=O)OC

InChI

InChI=1S/C24H21F3O7/c1-4-5-13-8-15-18(10-17(13)33-12(2)23(29)30-3)34-22(24(25,26)27)20(21(15)28)14-6-7-16-19(9-14)32-11-31-16/h6-10,12H,4-5,11H2,1-3H3