6-(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-4-oxidanyl-5-oxidanylidene-hexanoic acid

Systemtic Name: 6-(4-acetyloxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-4-oxidanyl-5-oxidanylidene-hexanoic acid Openeye Name: 6-(4-acetoxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-hydroxy-4-methyl-5-oxo-hexanoic acid CAS Name: 6-(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-hydroxy-4-methyl-5-oxohexanoic acid IUPAC Name: 6-(4-acetyloxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-hydroxy-4-methyl-5-oxohexanoic acid Traditional Name: 6-(4-acetoxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4-hydroxy-5-keto-4-methyl-hexanoic acid Formula: C19H22O9 MolecularWeight: 394.37258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)OC(=O)C)CC(=O)C(C)(CCC(=O)O)O)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)OC(=O)C)CC(=O)C(C)(CCC(=O)O)O)OC

InChI

InChI=1S/C19H22O9/c1-9-12-8-27-18(24)15(12)17(28-10(2)20)11(16(9)26-4)7-13(21)19(3,25)6-5-14(22)23/h25H,5-8H2,1-4H3,(H,22,23)