[(2R)-octan-2-yl] (2R,3S)-2-methyl-3-oxidanyl-butanoate

Systemtic Name: [(2R)-octan-2-yl] (2R,3S)-2-methyl-3-oxidanyl-butanoate Openeye Name: [(1R)-1-methylheptyl] (2R,3S)-3-hydroxy-2-methyl-butanoate CAS Name: (2R,3S)-3-hydroxy-2-methylbutanoic acid [(2R)-octan-2-yl] ester IUPAC Name: [(2R)-octan-2-yl] (2R,3S)-3-hydroxy-2-methylbutanoate Traditional Name: (2R,3S)-3-hydroxy-2-methyl-butyric acid [(1R)-1-methylheptyl] ester Formula: C13H26O3 MolecularWeight: 230.34374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C(C)C(C)O

Isomeric SMILES

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

InChI

InChI=1S/C13H26O3/c1-5-6-7-8-9-10(2)16-13(15)11(3)12(4)14/h10-12,14H,5-9H2,1-4H3/t10-,11-,12+/m1/s1