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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)CC(=O)O)OCC2CC3=C(O2)C=CC(=C3O)C(=O)C

Isomeric SMILES

CCCC1=C(C=CC(=C1)CC(=O)O)OCC2CC3=C(O2)C=CC(=C3O)C(=O)C

InChI

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