ethyl 5-[3-(4-tert-butylphenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 5-[3-(4-tert-butylphenoxy)-2-oxidanyl-propoxy]-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 5-[3-(4-tert-butylphenoxy)-2-hydroxy-propoxy]-4-oxo-chromene-2-carboxylate CAS Name: 5-[3-(4-tert-butylphenoxy)-2-hydroxypropoxy]-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-tert-butylphenoxy)-2-hydroxypropoxy]-4-oxochromene-2-carboxylate Traditional Name: 5-[3-(4-tert-butylphenoxy)-2-hydroxy-propoxy]-4-keto-chromene-2-carboxylic acid ethyl ester Formula: C25H28O7 MolecularWeight: 440.48562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=C(C=C3)C(C)(C)C)O

Isomeric SMILES

CCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=C(C=C3)C(C)(C)C)O

InChI

InChI=1S/C25H28O7/c1-5-29-24(28)22-13-19(27)23-20(7-6-8-21(23)32-22)31-15-17(26)14-30-18-11-9-16(10-12-18)25(2,3)4/h6-13,17,26H,5,14-15H2,1-4H3