O1-(2-methyl-2-adamantyl) O5-[(3-methyl-5-oxidanylidene-oxolan-3-yl)methyl] 2-ethyl-2,4,4-trimethyl-pentanedioate

Systemtic Name: O1-(2-methyl-2-adamantyl) O5-[(3-methyl-5-oxidanylidene-oxolan-3-yl)methyl] 2-ethyl-2,4,4-trimethyl-pentanedioate Openeye Name: O1-(2-methyl-2-adamantyl) O5-[(3-methyl-5-oxo-tetrahydrofuran-3-yl)methyl] 2-ethyl-2,4,4-trimethyl-pentanedioate CAS Name: 2-ethyl-2,4,4-trimethylpentanedioic acid O1-(2-methyl-2-adamantyl) ester O5-[(3-methyl-5-oxo-3-oxolanyl)methyl] ester IUPAC Name: 1-O-(2-methyl-2-adamantyl) 5-O-[(3-methyl-5-oxooxolan-3-yl)methyl] 2-ethyl-2,4,4-trimethylpentanedioate Traditional Name: 4-ethyl-2,2,4-trimethyl-glutaric acid O1-[(5-keto-3-methyl-tetrahydrofuran-3-yl)methyl] 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)OCC1(CC(=O)OC1)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C

Isomeric SMILES

CCC(C)(CC(C)(C)C(=O)OCC1(CC(=O)OC1)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C

InChI

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