[(4R,5S,6R)-5-methyl-6-oxidanyl-octan-4-yl] 2-methylpropanoate

Systemtic Name: [(4R,5S,6R)-5-methyl-6-oxidanyl-octan-4-yl] 2-methylpropanoate Openeye Name: [(1R,2S,3R)-3-hydroxy-2-methyl-1-propyl-pentyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [(4R,5S,6R)-6-hydroxy-5-methyloctan-4-yl] ester IUPAC Name: [(4R,5S,6R)-6-hydroxy-5-methyloctan-4-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [(1R,2S,3R)-3-hydroxy-2-methyl-1-propyl-pentyl] ester Formula: C13H26O3 MolecularWeight: 230.34374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26O3/c1-6-8-12(10(5)11(14)7-2)16-13(15)9(3)4/h9-12,14H,6-8H2,1-5H3/t10-,11+,12+/m0/s1