(E)-6-(6,7-dimethoxy-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid

Systemtic Name: (E)-6-(6,7-dimethoxy-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid Openeye Name: (E)-6-(4-hydroxy-6,7-dimethoxy-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid CAS Name: (E)-6-(4-hydroxy-6,7-dimethoxy-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid IUPAC Name: (E)-6-(4-hydroxy-6,7-dimethoxy-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Traditional Name: (E)-6-(4-hydroxy-3-keto-6,7-dimethoxy-phthalan-5-yl)-4-methyl-hex-4-enoic acid Formula: C17H20O7 MolecularWeight: 336.3365

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C2=C(COC2=O)C(=C1OC)OC)O)CCC(=O)O

Isomeric SMILES

C/C(=C\CC1=C(C2=C(COC2=O)C(=C1OC)OC)O)/CCC(=O)O

InChI

InChI=1S/C17H20O7/c1-9(5-7-12(18)19)4-6-10-14(20)13-11(8-24-17(13)21)16(23-3)15(10)22-2/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+