4-oxidanylidene-5-[2-oxidanyl-3-[3-(trifluoromethyl)phenoxy]propoxy]chromene-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-5-[2-oxidanyl-3-[3-(trifluoromethyl)phenoxy]propoxy]chromene-2-carboxylic acid Openeye Name: 5-[2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propoxy]-4-oxo-chromene-2-carboxylic acid CAS Name: 5-[2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propoxy]-4-oxo-1-benzopyran-2-carboxylic acid IUPAC Name: 5-[2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propoxy]-4-oxochromene-2-carboxylic acid Traditional Name: 5-[2-hydroxy-3-[3-(trifluoromethyl)phenoxy]propoxy]-4-keto-chromene-2-carboxylic acid Formula: C20H15F3O7 MolecularWeight: 424.32411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(COC2=CC=CC3=C2C(=O)C=C(O3)C(=O)O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OCC(COC2=CC=CC3=C2C(=O)C=C(O3)C(=O)O)O)C(F)(F)F

InChI

InChI=1S/C20H15F3O7/c21-20(22,23)11-3-1-4-13(7-11)28-9-12(24)10-29-15-5-2-6-16-18(15)14(25)8-17(30-16)19(26)27/h1-8,12,24H,9-10H2,(H,26,27)