7-[3-(2-tert-butylphenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylic acid

Systemtic Name: 7-[3-(2-tert-butylphenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylic acid Openeye Name: 7-[3-(2-tert-butylphenoxy)-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylic acid CAS Name: 7-[3-(2-tert-butylphenoxy)-2-hydroxypropoxy]-4-oxo-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-(2-tert-butylphenoxy)-2-hydroxypropoxy]-4-oxochromene-2-carboxylic acid Traditional Name: 7-[3-(2-tert-butylphenoxy)-2-hydroxy-propoxy]-4-keto-chromene-2-carboxylic acid Formula: C23H24O7 MolecularWeight: 412.43246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C(=O)O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OCC(COC2=CC3=C(C=C2)C(=O)C=C(O3)C(=O)O)O

InChI

InChI=1S/C23H24O7/c1-23(2,3)17-6-4-5-7-19(17)29-13-14(24)12-28-15-8-9-16-18(25)11-21(22(26)27)30-20(16)10-15/h4-11,14,24H,12-13H2,1-3H3,(H,26,27)