[(2S)-2,3-bis(oxidanyl)propyl] octanoate

Systemtic Name: [(2S)-2,3-bis(oxidanyl)propyl] octanoate Openeye Name: [(2S)-2,3-dihydroxypropyl] octanoate CAS Name: octanoic acid [(2S)-2,3-dihydroxypropyl] ester IUPAC Name: [(2S)-2,3-dihydroxypropyl] octanoate Traditional Name: caprylic acid [(2S)-2,3-dihydroxypropyl] ester Formula: C11H22O4 MolecularWeight: 218.28998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCC(CO)O

Isomeric SMILES

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

InChI

InChI=1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3/t10-/m0/s1