[3,5-bis(3-oxidanylpentan-3-yl)-1-adamantyl] 3-oxidanylidenebutanoate

Systemtic Name: [3,5-bis(3-oxidanylpentan-3-yl)-1-adamantyl] 3-oxidanylidenebutanoate Openeye Name: [3,5-bis(1-ethyl-1-hydroxy-propyl)-1-adamantyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [3,5-bis(3-hydroxypentan-3-yl)-1-adamantyl] ester IUPAC Name: [3,5-bis(3-hydroxypentan-3-yl)-1-adamantyl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [3,5-bis(1-ethyl-1-hydroxy-propyl)-1-adamantyl] ester Formula: C24H40O5 MolecularWeight: 408.5714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C12CC3CC(C1)(CC(C3)(C2)OC(=O)CC(=O)C)C(CC)(CC)O)O

Isomeric SMILES

CCC(CC)(C12CC3CC(C1)(CC(C3)(C2)OC(=O)CC(=O)C)C(CC)(CC)O)O

InChI

InChI=1S/C24H40O5/c1-6-23(27,7-2)20-11-18-12-21(14-20,24(28,8-3)9-4)16-22(13-18,15-20)29-19(26)10-17(5)25/h18,27-28H,6-16H2,1-5H3