O1-(2-methyl-2-adamantyl) O5-(4-methyl-2-oxidanylidene-oxan-4-yl) 2-ethyl-2,4,4-trimethyl-pentanedioate

Systemtic Name: O1-(2-methyl-2-adamantyl) O5-(4-methyl-2-oxidanylidene-oxan-4-yl) 2-ethyl-2,4,4-trimethyl-pentanedioate Openeye Name: O1-(2-methyl-2-adamantyl) O5-(4-methyl-2-oxo-tetrahydropyran-4-yl) 2-ethyl-2,4,4-trimethyl-pentanedioate CAS Name: 2-ethyl-2,4,4-trimethylpentanedioic acid O1-(2-methyl-2-adamantyl) ester O5-(4-methyl-2-oxo-4-oxanyl) ester IUPAC Name: 1-O-(2-methyl-2-adamantyl) 5-O-(4-methyl-2-oxooxan-4-yl) 2-ethyl-2,4,4-trimethylpentanedioate Traditional Name: 4-ethyl-2,2,4-trimethyl-glutaric acid O1-(2-keto-4-methyl-tetrahydropyran-4-yl) ester O5-(2-methyl-2-adamantyl) ester Formula: C27H42O6 MolecularWeight: 462.61878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(C)C(=O)OC1(CCOC(=O)C1)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C

Isomeric SMILES

CCC(C)(CC(C)(C)C(=O)OC1(CCOC(=O)C1)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C

InChI

InChI=1S/C27H42O6/c1-7-25(4,16-24(2,3)22(29)32-26(5)8-9-31-21(28)15-26)23(30)33-27(6)19-11-17-10-18(13-19)14-20(27)12-17/h17-20H,7-16H2,1-6H3