methyl 4-[7-hexoxy-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]-5-methyl-furan-2-carboxylate

Systemtic Name: methyl 4-[7-hexoxy-4-oxidanylidene-2-(trifluoromethyl)chromen-3-yl]-5-methyl-furan-2-carboxylate Openeye Name: methyl 4-[7-hexoxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]-5-methyl-furan-2-carboxylate CAS Name: 4-[7-hexoxy-4-oxo-2-(trifluoromethyl)-1-benzopyran-3-yl]-5-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 4-[7-hexoxy-4-oxo-2-(trifluoromethyl)chromen-3-yl]-5-methylfuran-2-carboxylate Traditional Name: 4-[7-hexoxy-4-keto-2-(trifluoromethyl)chromen-3-yl]-5-methyl-furan-2-carboxylic acid methyl ester Formula: C23H23F3O6 MolecularWeight: 452.42033

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=C(OC(=C3)C(=O)OC)C

Isomeric SMILES

CCCCCCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=C(OC(=C3)C(=O)OC)C

InChI

InChI=1S/C23H23F3O6/c1-4-5-6-7-10-30-14-8-9-15-17(11-14)32-21(23(24,25)26)19(20(15)27)16-12-18(22(28)29-3)31-13(16)2/h8-9,11-12H,4-7,10H2,1-3H3