3-[6-ethanoyl-4-(methoxymethoxy)-3-oxidanylidene-1-benzofuran-5-yl]-2-methyl-butanoic acid

Systemtic Name: 3-[6-ethanoyl-4-(methoxymethoxy)-3-oxidanylidene-1-benzofuran-5-yl]-2-methyl-butanoic acid Openeye Name: 3-[6-acetyl-4-(methoxymethoxy)-3-oxo-benzofuran-5-yl]-2-methyl-butanoic acid CAS Name: 3-[6-acetyl-4-(methoxymethoxy)-3-oxo-5-benzofuranyl]-2-methylbutanoic acid IUPAC Name: 3-[6-acetyl-4-(methoxymethoxy)-3-oxo-1-benzofuran-5-yl]-2-methylbutanoic acid Traditional Name: 3-[6-acetyl-3-keto-4-(methoxymethoxy)coumaran-5-yl]-2-methyl-butyric acid Formula: C17H20O7 MolecularWeight: 336.3365

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C2=C(C=C1C(=O)C)OCC2=O)OCOC)C(C)C(=O)O

Isomeric SMILES

CC(C1=C(C2=C(C=C1C(=O)C)OCC2=O)OCOC)C(C)C(=O)O

InChI

InChI=1S/C17H20O7/c1-8(9(2)17(20)21)14-11(10(3)18)5-13-15(12(19)6-23-13)16(14)24-7-22-4/h5,8-9H,6-7H2,1-4H3,(H,20,21)