bis(oxan-2-yl) 5-[2-ethyl-4-methyl-5-[(3-oxidanyl-1-adamantyl)oxy]-5-oxidanylidene-pentanoyl]oxyadamantane-1,3-dicarboxylate

Systemtic Name: bis(oxan-2-yl) 5-[2-ethyl-4-methyl-5-[(3-oxidanyl-1-adamantyl)oxy]-5-oxidanylidene-pentanoyl]oxyadamantane-1,3-dicarboxylate Openeye Name: ditetrahydropyran-2-yl 5-[2-ethyl-5-[(3-hydroxy-1-adamantyl)oxy]-4-methyl-5-oxo-pentanoyl]oxyadamantane-1,3-dicarboxylate CAS Name: 5-[2-ethyl-5-[(3-hydroxy-1-adamantyl)oxy]-4-methyl-1,5-dioxopentoxy]adamantane-1,3-dicarboxylic acid bis(2-oxanyl) ester IUPAC Name: bis(oxan-2-yl) 5-[2-ethyl-5-[(3-hydroxy-1-adamantyl)oxy]-4-methyl-5-oxopentanoyl]oxyadamantane-1,3-dicarboxylate Traditional Name: 5-[2-ethyl-5-[(3-hydroxy-1-adamantyl)oxy]-5-keto-4-methyl-pentanoyl]oxyadamantane-1,3-dicarboxylic acid ditetrahydropyran-2-yl ester Formula: C40H58O11 MolecularWeight: 714.88192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)OC12CC3CC(C1)CC(C3)(C2)O)C(=O)OC45CC6CC(C4)(CC(C6)(C5)C(=O)OC7CCCCO7)C(=O)OC8CCCCO8

Isomeric SMILES

CCC(CC(C)C(=O)OC12CC3CC(C1)CC(C3)(C2)O)C(=O)OC45CC6CC(C4)(CC(C6)(C5)C(=O)OC7CCCCO7)C(=O)OC8CCCCO8

InChI

InChI=1S/C40H58O11/c1-3-29(12-25(2)32(41)50-39-18-26-13-27(19-39)17-38(45,16-26)24-39)33(42)51-40-20-28-14-36(22-40,34(43)48-30-8-4-6-10-46-30)21-37(15-28,23-40)35(44)49-31-9-5-7-11-47-31/h25-31,45H,3-24H2,1-2H3