2-(3-oxidanyl-1-adamantyl)butan-2-yl 2,2-dimethylbutanoate

Systemtic Name: 2-(3-oxidanyl-1-adamantyl)butan-2-yl 2,2-dimethylbutanoate Openeye Name: [1-(3-hydroxy-1-adamantyl)-1-methyl-propyl] 2,2-dimethylbutanoate CAS Name: 2,2-dimethylbutanoic acid 2-(3-hydroxy-1-adamantyl)butan-2-yl ester IUPAC Name: 2-(3-hydroxy-1-adamantyl)butan-2-yl 2,2-dimethylbutanoate Traditional Name: 2,2-dimethylbutyric acid [1-(3-hydroxy-1-adamantyl)-1-methyl-propyl] ester Formula: C20H34O3 MolecularWeight: 322.48216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H34O3/c1-6-17(3,4)16(21)23-18(5,7-2)19-9-14-8-15(10-19)12-20(22,11-14)13-19/h14-15,22H,6-13H2,1-5H3