methyl 6-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-7-methyl-1-benzofuran-2-carboxylate

Systemtic Name: methyl 6-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-7-methyl-1-benzofuran-2-carboxylate Openeye Name: methyl 6-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-7-methyl-benzofuran-2-carboxylate CAS Name: 6-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-7-methyl-2-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 6-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-7-methyl-1-benzofuran-2-carboxylate Traditional Name: 6-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-7-methyl-coumarilic acid methyl ester Formula: C25H28O7 MolecularWeight: 440.48562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(C=C2)C=C(O3)C(=O)OC)C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(C=C2)C=C(O3)C(=O)OC)C

InChI

InChI=1S/C25H28O7/c1-5-7-19-21(11-9-18(16(3)26)23(19)27)31-13-6-12-30-20-10-8-17-14-22(25(28)29-4)32-24(17)15(20)2/h8-11,14,27H,5-7,12-13H2,1-4H3