O1-(1-adamantyl) O5-(3-oxidanylidenecyclohexyl) 2-ethyl-2,4,4-trimethyl-pentanedioate

Systemtic Name: O1-(1-adamantyl) O5-(3-oxidanylidenecyclohexyl) 2-ethyl-2,4,4-trimethyl-pentanedioate Openeye Name: O1-(1-adamantyl) O5-(3-oxocyclohexyl) 2-ethyl-2,4,4-trimethyl-pentanedioate CAS Name: 2-ethyl-2,4,4-trimethylpentanedioic acid O1-(1-adamantyl) ester O5-(3-oxocyclohexyl) ester IUPAC Name: 1-O-(1-adamantyl) 5-O-(3-oxocyclohexyl) 2-ethyl-2,4,4-trimethylpentanedioate Traditional Name: 2-ethyl-2,4,4-trimethyl-glutaric acid O1-(1-adamantyl) ester O5-(3-ketocyclohexyl) ester Formula: C26H40O5 MolecularWeight: 432.5928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(C)C(=O)OC1CCCC(=O)C1)C(=O)OC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC(C)(CC(C)(C)C(=O)OC1CCCC(=O)C1)C(=O)OC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C26H40O5/c1-5-25(4,16-24(2,3)22(28)30-21-8-6-7-20(27)12-21)23(29)31-26-13-17-9-18(14-26)11-19(10-17)15-26/h17-19,21H,5-16H2,1-4H3