O1-[2-(1-adamantyl)propan-2-yl] O5-(2-hydroxyethyl) 2-ethyl-2,4,4-trimethyl-pentanedioate

Systemtic Name: O1-[2-(1-adamantyl)propan-2-yl] O5-(2-hydroxyethyl) 2-ethyl-2,4,4-trimethyl-pentanedioate Openeye Name: O1-[1-(1-adamantyl)-1-methyl-ethyl] O5-(2-hydroxyethyl) 2-ethyl-2,4,4-trimethyl-pentanedioate CAS Name: 2-ethyl-2,4,4-trimethylpentanedioic acid O1-[2-(1-adamantyl)propan-2-yl] ester O5-(2-hydroxyethyl) ester IUPAC Name: 1-O-[2-(1-adamantyl)propan-2-yl] 5-O-(2-hydroxyethyl) 2-ethyl-2,4,4-trimethylpentanedioate Traditional Name: 2-ethyl-2,4,4-trimethyl-glutaric acid O1-[1-(1-adamantyl)-1-methyl-ethyl] ester O5-(2-hydroxyethyl) ester Formula: C25H42O5 MolecularWeight: 422.59798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(C)C(=O)OCCO)C(=O)OC(C)(C)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCC(C)(CC(C)(C)C(=O)OCCO)C(=O)OC(C)(C)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C25H42O5/c1-7-24(6,16-22(2,3)20(27)29-9-8-26)21(28)30-23(4,5)25-13-17-10-18(14-25)12-19(11-17)15-25/h17-19,26H,7-16H2,1-6H3