[3-(3-oxidanylpentan-3-yl)-1-adamantyl] 3-oxidanylidenebutanoate

Systemtic Name: [3-(3-oxidanylpentan-3-yl)-1-adamantyl] 3-oxidanylidenebutanoate Openeye Name: [3-(1-ethyl-1-hydroxy-propyl)-1-adamantyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [3-(3-hydroxypentan-3-yl)-1-adamantyl] ester IUPAC Name: [3-(3-hydroxypentan-3-yl)-1-adamantyl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [3-(1-ethyl-1-hydroxy-propyl)-1-adamantyl] ester Formula: C19H30O4 MolecularWeight: 322.4391

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30O4/c1-4-19(22,5-2)17-8-14-7-15(9-17)11-18(10-14,12-17)23-16(21)6-13(3)20/h14-15,22H,4-12H2,1-3H3