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

Systemtic Name: 4-[2-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-2,3-dihydro-1-benzofuran-5-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-2,3-dihydrobenzofuran-5-yl]-4-oxo-butanoic acid CAS Name: 4-[2-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-2,3-dihydrobenzofuran-5-yl]-4-oxobutanoic acid IUPAC Name: 4-[2-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-2,3-dihydro-1-benzofuran-5-yl]-4-oxobutanoic acid Traditional Name: 4-[2-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]coumaran-5-yl]-4-keto-butyric acid Formula: C24H26O7 MolecularWeight: 426.45904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2CC3=C(O2)C=CC(=C3)C(=O)CCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2CC3=C(O2)C=CC(=C3)C(=O)CCC(=O)O

InChI

InChI=1S/C24H26O7/c1-3-4-19-22(9-6-18(14(2)25)24(19)29)30-13-17-12-16-11-15(5-8-21(16)31-17)20(26)7-10-23(27)28/h5-6,8-9,11,17,29H,3-4,7,10,12-13H2,1-2H3,(H,27,28)