2-[2-[2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-1-oxidanyl-ethyl]-2,3-dihydro-1-benzofuran-5-yl]ethanoic acid

Systemtic Name: 2-[2-[2-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-1-oxidanyl-ethyl]-2,3-dihydro-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[2-[2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-1-hydroxy-ethyl]-2,3-dihydrobenzofuran-5-yl]acetic acid CAS Name: 2-[2-[2-(4-acetyl-3-hydroxy-2-propylphenoxy)-1-hydroxyethyl]-2,3-dihydrobenzofuran-5-yl]acetic acid IUPAC Name: 2-[2-[2-(4-acetyl-3-hydroxy-2-propylphenoxy)-1-hydroxyethyl]-2,3-dihydro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[2-[2-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-1-hydroxy-ethyl]coumaran-5-yl]acetic acid Formula: C23H26O7 MolecularWeight: 414.44834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(C2CC3=C(O2)C=CC(=C3)CC(=O)O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(C2CC3=C(O2)C=CC(=C3)CC(=O)O)O

InChI

InChI=1S/C23H26O7/c1-3-4-17-20(8-6-16(13(2)24)23(17)28)29-12-18(25)21-11-15-9-14(10-22(26)27)5-7-19(15)30-21/h5-9,18,21,25,28H,3-4,10-12H2,1-2H3,(H,26,27)