(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate CAS Name: 5-[3-(trifluoromethyl)phenyl]-2-furancarboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate Traditional Name: 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C24H17F3O5 MolecularWeight: 442.38399

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F)C

InChI

InChI=1S/C24H17F3O5/c1-13-6-7-18-16(11-21(28)32-22(18)14(13)2)12-30-23(29)20-9-8-19(31-20)15-4-3-5-17(10-15)24(25,26)27/h3-11H,12H2,1-2H3