[(2S,5S)-7-methyl-5-oxidanyl-3-oxidanylidene-octan-2-yl] 2,2-dimethylpropanoate

Systemtic Name: [(2S,5S)-7-methyl-5-oxidanyl-3-oxidanylidene-octan-2-yl] 2,2-dimethylpropanoate Openeye Name: [(1S,4S)-4-hydroxy-1,6-dimethyl-2-oxo-heptyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2S,5S)-5-hydroxy-7-methyl-3-oxooctan-2-yl] ester IUPAC Name: [(2S,5S)-5-hydroxy-7-methyl-3-oxooctan-2-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(1S,4S)-4-hydroxy-2-keto-1,6-dimethyl-heptyl] ester Formula: C14H26O4 MolecularWeight: 258.35384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)C(C)OC(=O)C(C)(C)C)O

Isomeric SMILES

C[C@@H](C(=O)C[C@H](CC(C)C)O)OC(=O)C(C)(C)C

InChI

InChI=1S/C14H26O4/c1-9(2)7-11(15)8-12(16)10(3)18-13(17)14(4,5)6/h9-11,15H,7-8H2,1-6H3/t10-,11-/m0/s1