5-ethanoyl-6-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 5-ethanoyl-6-[5-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)pentoxy]-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 5-acetyl-6-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 5-acetyl-6-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 5-acetyl-6-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentoxy]-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 5-acetyl-6-[5-(4-acetyl-3-hydroxy-2-propyl-phenoxy)pentoxy]coumaran-2-carboxylic acid Formula: C27H32O8 MolecularWeight: 484.53818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=CC3=C(CC(O3)C(=O)O)C=C2C(=O)C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCOC2=CC3=C(CC(O3)C(=O)O)C=C2C(=O)C

InChI

InChI=1S/C27H32O8/c1-4-8-20-22(10-9-19(16(2)28)26(20)30)33-11-6-5-7-12-34-24-15-23-18(13-21(24)17(3)29)14-25(35-23)27(31)32/h9-10,13,15,25,30H,4-8,11-12,14H2,1-3H3,(H,31,32)