ethyl 3-methyl-5-[7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[7-oxidanyl-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-[7-hydroxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]-3-methyl-benzofuran-2-carboxylate CAS Name: 5-[7-hydroxy-4-oxo-2-(trifluoromethyl)-1-benzopyran-3-yl]-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[7-hydroxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-[7-hydroxy-4-keto-2-(trifluoromethyl)chromen-3-yl]-3-methyl-coumarilic acid ethyl ester Formula: C22H15F3O6 MolecularWeight: 432.34611

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)C3=C(OC4=C(C3=O)C=CC(=C4)O)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)C3=C(OC4=C(C3=O)C=CC(=C4)O)C(F)(F)F)C

InChI

InChI=1S/C22H15F3O6/c1-3-29-21(28)19-10(2)14-8-11(4-7-15(14)30-19)17-18(27)13-6-5-12(26)9-16(13)31-20(17)22(23,24)25/h4-9,26H,3H2,1-2H3