[(3R,4S,5R)-2,4,6-trimethyl-5-oxidanyl-heptan-3-yl] 2-methylpropanoate

Systemtic Name: [(3R,4S,5R)-2,4,6-trimethyl-5-oxidanyl-heptan-3-yl] 2-methylpropanoate Openeye Name: [(1R,2S,3R)-3-hydroxy-1-isopropyl-2,4-dimethyl-pentyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [(3R,4S,5R)-5-hydroxy-2,4,6-trimethylheptan-3-yl] ester IUPAC Name: [(3R,4S,5R)-5-hydroxy-2,4,6-trimethylheptan-3-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [(1R,2S,3R)-3-hydroxy-1-isopropyl-2,4-dimethyl-pentyl] ester Formula: C14H28O3 MolecularWeight: 244.37032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H28O3/c1-8(2)12(15)11(7)13(9(3)4)17-14(16)10(5)6/h8-13,15H,1-7H3/t11-,12+,13+/m0/s1