O1-(oxan-2-yl) O5-[2-(3-oxidanyl-1-adamantyl)propan-2-yl] 4-ethyl-2,2,4-trimethyl-pentanedioate

Systemtic Name: O1-(oxan-2-yl) O5-[2-(3-oxidanyl-1-adamantyl)propan-2-yl] 4-ethyl-2,2,4-trimethyl-pentanedioate Openeye Name: O1-[1-(3-hydroxy-1-adamantyl)-1-methyl-ethyl] O5-tetrahydropyran-2-yl 2-ethyl-2,4,4-trimethyl-pentanedioate CAS Name: 2-ethyl-2,4,4-trimethylpentanedioic acid O1-[2-(3-hydroxy-1-adamantyl)propan-2-yl] ester O5-(2-oxanyl) ester IUPAC Name: 1-O-[2-(3-hydroxy-1-adamantyl)propan-2-yl] 5-O-(oxan-2-yl) 2-ethyl-2,4,4-trimethylpentanedioate Traditional Name: 2-ethyl-2,4,4-trimethyl-glutaric acid O1-[1-(3-hydroxy-1-adamantyl)-1-methyl-ethyl] ester O5-tetrahydropyran-2-yl ester Formula: C28H46O6 MolecularWeight: 478.66124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(C)C(=O)OC1CCCCO1)C(=O)OC(C)(C)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CCC(C)(CC(C)(C)C(=O)OC1CCCCO1)C(=O)OC(C)(C)C23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C28H46O6/c1-7-26(6,17-24(2,3)22(29)33-21-10-8-9-11-32-21)23(30)34-25(4,5)27-13-19-12-20(14-27)16-28(31,15-19)18-27/h19-21,31H,7-18H2,1-6H3