methyl (2R,3S)-2-methyl-3-oxidanyl-5-oxidanylidene-decanoate

Systemtic Name: methyl (2R,3S)-2-methyl-3-oxidanyl-5-oxidanylidene-decanoate Openeye Name: methyl (2R,3S)-3-hydroxy-2-methyl-5-oxo-decanoate CAS Name: (2R,3S)-3-hydroxy-2-methyl-5-oxodecanoic acid methyl ester IUPAC Name: methyl (2R,3S)-3-hydroxy-2-methyl-5-oxodecanoate Traditional Name: (2R,3S)-3-hydroxy-5-keto-2-methyl-capric acid methyl ester Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H22O4/c1-4-5-6-7-10(13)8-11(14)9(2)12(15)16-3/h9,11,14H,4-8H2,1-3H3/t9-,11+/m1/s1