5-[[3-(4-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[3-(4-methoxyphenoxy)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[4-keto-3-(4-methoxyphenoxy)-2-(trifluoromethyl)chromen-7-yl]oxymethyl]-2-furoic acid Formula: C23H15F3O8 MolecularWeight: 476.35561

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)C(F)(F)F

InChI

InChI=1S/C23H15F3O8/c1-30-12-2-4-13(5-3-12)33-20-19(27)16-8-6-14(10-18(16)34-21(20)23(24,25)26)31-11-15-7-9-17(32-15)22(28)29/h2-10H,11H2,1H3,(H,28,29)