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

Systemtic Name: 2-[2-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-2,3-dihydro-1-benzofuran-5-yl]ethanoic acid Openeye Name: 2-[2-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-2,3-dihydrobenzofuran-5-yl]acetic acid CAS Name: 2-[2-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-2,3-dihydrobenzofuran-5-yl]acetic acid IUPAC Name: 2-[2-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-2,3-dihydro-1-benzofuran-5-yl]acetic acid Traditional Name: 2-[2-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]coumaran-5-yl]acetic acid Formula: C22H24O6 MolecularWeight: 384.42236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24O6/c1-3-4-18-20(8-6-17(13(2)23)22(18)26)27-12-16-11-15-9-14(10-21(24)25)5-7-19(15)28-16/h5-9,16,26H,3-4,10-12H2,1-2H3,(H,24,25)