3-(2,2,3,3-tetramethylbutanoyloxy)adamantane-1-carboxylic acid

Systemtic Name: 3-(2,2,3,3-tetramethylbutanoyloxy)adamantane-1-carboxylic acid Openeye Name: 3-(2,2,3,3-tetramethylbutanoyloxy)adamantane-1-carboxylic acid CAS Name: 3-(2,2,3,3-tetramethyl-1-oxobutoxy)-1-adamantanecarboxylic acid IUPAC Name: 3-(2,2,3,3-tetramethylbutanoyloxy)adamantane-1-carboxylic acid Traditional Name: 3-(2,2,3,3-tetramethylbutanoyloxy)adamantane-1-carboxylic acid Formula: C19H30O4 MolecularWeight: 322.4391

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C)(C)C(=O)OC12CC3CC(C1)CC(C3)(C2)C(=O)O

Isomeric SMILES

CC(C)(C)C(C)(C)C(=O)OC12CC3CC(C1)CC(C3)(C2)C(=O)O

InChI

InChI=1S/C19H30O4/c1-16(2,3)17(4,5)15(22)23-19-9-12-6-13(10-19)8-18(7-12,11-19)14(20)21/h12-13H,6-11H2,1-5H3,(H,20,21)