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

Systemtic Name: O1-methyl O5-(2-methyl-2-adamantyl) 2-ethyl-4-[(3,5,5-trimethyl-2-oxidanylidene-oxolan-3-yl)methyl]pentanedioate Openeye Name: O1-methyl O5-(2-methyl-2-adamantyl) 2-ethyl-4-[(3,5,5-trimethyl-2-oxo-tetrahydrofuran-3-yl)methyl]pentanedioate CAS Name: 2-ethyl-4-[(3,5,5-trimethyl-2-oxo-3-oxolanyl)methyl]pentanedioic acid O1-methyl ester O5-(2-methyl-2-adamantyl) ester IUPAC Name: 1-O-methyl 5-O-(2-methyl-2-adamantyl) 2-ethyl-4-[(3,5,5-trimethyl-2-oxooxolan-3-yl)methyl]pentanedioate Traditional Name: 2-ethyl-4-[(2-keto-3,5,5-trimethyl-tetrahydrofuran-3-yl)methyl]glutaric acid O1-methyl ester O5-(2-methyl-2-adamantyl) ester Formula: C27H42O6 MolecularWeight: 462.61878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC1(CC(OC1=O)(C)C)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C)C(=O)OC

Isomeric SMILES

CCC(CC(CC1(CC(OC1=O)(C)C)C)C(=O)OC2(C3CC4CC(C3)CC2C4)C)C(=O)OC

InChI

InChI=1S/C27H42O6/c1-7-18(22(28)31-6)13-19(14-26(4)15-25(2,3)33-24(26)30)23(29)32-27(5)20-9-16-8-17(11-20)12-21(27)10-16/h16-21H,7-15H2,1-6H3