2-ethyl-4-methoxycarbonyl-2,4,6,6-tetramethyl-7-[3-(2-methylprop-2-enoyloxy)-2-oxidanyl-propoxy]-7-oxidanylidene-heptanoic acid

Systemtic Name: 2-ethyl-4-methoxycarbonyl-2,4,6,6-tetramethyl-7-[3-(2-methylprop-2-enoyloxy)-2-oxidanyl-propoxy]-7-oxidanylidene-heptanoic acid Openeye Name: 2-ethyl-7-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-4-methoxycarbonyl-2,4,6,6-tetramethyl-7-oxo-heptanoic acid CAS Name: 2-ethyl-7-[2-hydroxy-3-(2-methyl-1-oxoprop-2-enoxy)propoxy]-4-methoxycarbonyl-2,4,6,6-tetramethyl-7-oxoheptanoic acid IUPAC Name: 2-ethyl-7-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-4-methoxycarbonyl-2,4,6,6-tetramethyl-7-oxoheptanoic acid Traditional Name: 4-carbomethoxy-2-ethyl-7-(2-hydroxy-3-methacryloyloxy-propoxy)-7-keto-2,4,6,6-tetramethyl-enanthic acid Formula: C22H36O9 MolecularWeight: 444.51584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(CC(C)(C)C(=O)OCC(COC(=O)C(=C)C)O)C(=O)OC)C(=O)O

Isomeric SMILES

CCC(C)(CC(C)(CC(C)(C)C(=O)OCC(COC(=O)C(=C)C)O)C(=O)OC)C(=O)O

InChI

InChI=1S/C22H36O9/c1-9-21(6,17(25)26)13-22(7,19(28)29-8)12-20(4,5)18(27)31-11-15(23)10-30-16(24)14(2)3/h15,23H,2,9-13H2,1,3-8H3,(H,25,26)