methyl 4-[2-[2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)ethyl]-2,3-dihydro-1-benzofuran-5-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[2-[2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)ethyl]-2,3-dihydro-1-benzofuran-5-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-[2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)ethyl]-2,3-dihydrobenzofuran-5-yl]-4-oxo-butanoate CAS Name: 4-[2-[2-(4-acetyl-3-hydroxy-2-propylphenoxy)ethyl]-2,3-dihydrobenzofuran-5-yl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-[2-(4-acetyl-3-hydroxy-2-propylphenoxy)ethyl]-2,3-dihydro-1-benzofuran-5-yl]-4-oxobutanoate Traditional Name: 4-[2-[2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)ethyl]coumaran-5-yl]-4-keto-butyric acid methyl ester Formula: C26H30O7 MolecularWeight: 454.5122

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCC2CC3=C(O2)C=CC(=C3)C(=O)CCC(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCC2CC3=C(O2)C=CC(=C3)C(=O)CCC(=O)OC

InChI

InChI=1S/C26H30O7/c1-4-5-21-24(10-7-20(16(2)27)26(21)30)32-13-12-19-15-18-14-17(6-9-23(18)33-19)22(28)8-11-25(29)31-3/h6-7,9-10,14,19,30H,4-5,8,11-13,15H2,1-3H3