O1-[3-(3-oxidanyl-1-adamantyl)pentan-3-yl] O5-[2-(4-oxidanylidene-1-adamantyl)propan-2-yl] 4-ethyl-2-methyl-pentanedioate

Systemtic Name: O1-[3-(3-oxidanyl-1-adamantyl)pentan-3-yl] O5-[2-(4-oxidanylidene-1-adamantyl)propan-2-yl] 4-ethyl-2-methyl-pentanedioate Openeye Name: O1-[1-ethyl-1-(3-hydroxy-1-adamantyl)propyl] O5-[1-methyl-1-(4-oxo-1-adamantyl)ethyl] 4-ethyl-2-methyl-pentanedioate CAS Name: 4-ethyl-2-methylpentanedioic acid O1-[3-(3-hydroxy-1-adamantyl)pentan-3-yl] ester O5-[2-(4-oxo-1-adamantyl)propan-2-yl] ester IUPAC Name: 1-O-[3-(3-hydroxy-1-adamantyl)pentan-3-yl] 5-O-[2-(4-oxo-1-adamantyl)propan-2-yl] 4-ethyl-2-methylpentanedioate Traditional Name: 4-ethyl-2-methyl-glutaric acid O1-[1-ethyl-1-(3-hydroxy-1-adamantyl)propyl] ester O5-[1-(4-keto-1-adamantyl)-1-methyl-ethyl] ester Formula: C36H56O6 MolecularWeight: 584.82624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)C(=O)OC(CC)(CC)C12CC3CC(C1)CC(C3)(C2)O)C(=O)OC(C)(C)C45CC6CC(C4)C(=O)C(C6)C5

Isomeric SMILES

CCC(CC(C)C(=O)OC(CC)(CC)C12CC3CC(C1)CC(C3)(C2)O)C(=O)OC(C)(C)C45CC6CC(C4)C(=O)C(C6)C5

InChI

InChI=1S/C36H56O6/c1-7-26(31(39)41-32(5,6)33-14-23-12-27(19-33)29(37)28(13-23)20-33)10-22(4)30(38)42-36(8-2,9-3)34-15-24-11-25(16-34)18-35(40,17-24)21-34/h22-28,40H,7-21H2,1-6H3