4-oxidanylidene-7-[2-oxidanyl-3-(2-propylphenoxy)propoxy]-6-propyl-chromene-2-carboxylic acid

Systemtic Name: 4-oxidanylidene-7-[2-oxidanyl-3-(2-propylphenoxy)propoxy]-6-propyl-chromene-2-carboxylic acid Openeye Name: 7-[2-hydroxy-3-(2-propylphenoxy)propoxy]-4-oxo-6-propyl-chromene-2-carboxylic acid CAS Name: 7-[2-hydroxy-3-(2-propylphenoxy)propoxy]-4-oxo-6-propyl-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[2-hydroxy-3-(2-propylphenoxy)propoxy]-4-oxo-6-propylchromene-2-carboxylic acid Traditional Name: 7-[2-hydroxy-3-(2-propylphenoxy)propoxy]-4-keto-6-propyl-chromene-2-carboxylic acid Formula: C25H28O7 MolecularWeight: 440.48562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1OCC(COC2=C(C=C3C(=C2)OC(=CC3=O)C(=O)O)CCC)O

Isomeric SMILES

CCCC1=CC=CC=C1OCC(COC2=C(C=C3C(=C2)OC(=CC3=O)C(=O)O)CCC)O

InChI

InChI=1S/C25H28O7/c1-3-7-16-9-5-6-10-21(16)30-14-18(26)15-31-22-13-23-19(11-17(22)8-4-2)20(27)12-24(32-23)25(28)29/h5-6,9-13,18,26H,3-4,7-8,14-15H2,1-2H3,(H,28,29)