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

Systemtic Name: O1-(2-ethyl-2-adamantyl) O5-methyl 4-ethyl-2-[(3,5,5-trimethyl-2-oxidanylidene-oxolan-3-yl)methyl]pentanedioate Openeye Name: O1-(2-ethyl-2-adamantyl) O5-methyl 4-ethyl-2-[(3,5,5-trimethyl-2-oxo-tetrahydrofuran-3-yl)methyl]pentanedioate CAS Name: 4-ethyl-2-[(3,5,5-trimethyl-2-oxo-3-oxolanyl)methyl]pentanedioic acid O1-(2-ethyl-2-adamantyl) ester O5-methyl ester IUPAC Name: 1-O-(2-ethyl-2-adamantyl) 5-O-methyl 4-ethyl-2-[(3,5,5-trimethyl-2-oxooxolan-3-yl)methyl]pentanedioate Traditional Name: 4-ethyl-2-[(2-keto-3,5,5-trimethyl-tetrahydrofuran-3-yl)methyl]glutaric acid O1-(2-ethyl-2-adamantyl) ester O5-methyl ester Formula: C28H44O6 MolecularWeight: 476.64536

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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)CC)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C28H44O6/c1-7-19(23(29)32-6)14-20(15-27(5)16-26(3,4)34-25(27)31)24(30)33-28(8-2)21-10-17-9-18(12-21)13-22(28)11-17/h17-22H,7-16H2,1-6H3