O1-(2-ethyl-2-adamantyl) O5-(7-oxidanylidene-6-oxabicyclo[3.2.1]octan-5-yl) 2-ethyl-4-methyl-pentanedioate

Systemtic Name: O1-(2-ethyl-2-adamantyl) O5-(7-oxidanylidene-6-oxabicyclo[3.2.1]octan-5-yl) 2-ethyl-4-methyl-pentanedioate Openeye Name: O1-(2-ethyl-2-adamantyl) O5-(7-oxo-6-oxabicyclo[3.2.1]octan-5-yl) 2-ethyl-4-methyl-pentanedioate CAS Name: 2-ethyl-4-methylpentanedioic acid O1-(2-ethyl-2-adamantyl) ester O5-(7-oxo-6-oxabicyclo[3.2.1]octan-5-yl) ester IUPAC Name: 1-O-(2-ethyl-2-adamantyl) 5-O-(7-oxo-6-oxabicyclo[3.2.1]octan-5-yl) 2-ethyl-4-methylpentanedioate Traditional Name: 2-ethyl-4-methyl-glutaric acid O1-(2-ethyl-2-adamantyl) ester O5-(7-keto-6-oxabicyclo[3.2.1]octan-5-yl) ester Formula: C27H40O6 MolecularWeight: 460.6029

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)OC12CCCC(C1)C(=O)O2)C(=O)OC3(C4CC5CC(C4)CC3C5)CC

Isomeric SMILES

CCC(CC(C)C(=O)OC12CCCC(C1)C(=O)O2)C(=O)OC3(C4CC5CC(C4)CC3C5)CC

InChI

InChI=1S/C27H40O6/c1-4-19(9-16(3)23(28)31-26-8-6-7-20(15-26)25(30)32-26)24(29)33-27(5-2)21-11-17-10-18(13-21)14-22(27)12-17/h16-22H,4-15H2,1-3H3