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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(OC2=C1C(=C(C=C2)C(=O)C)O)COC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

CCCC1C(OC2=C1C(=C(C=C2)C(=O)C)O)COC3=CC=C(C=C3)CC(=O)O

InChI

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