1,3-bis(oxidanyl)propan-2-yl 2,2,3-trimethylnonanoate

Systemtic Name: 1,3-bis(oxidanyl)propan-2-yl 2,2,3-trimethylnonanoate Openeye Name: [2-hydroxy-1-(hydroxymethyl)ethyl] 2,2,3-trimethylnonanoate CAS Name: 2,2,3-trimethylnonanoic acid 1,3-dihydroxypropan-2-yl ester IUPAC Name: 1,3-dihydroxypropan-2-yl 2,2,3-trimethylnonanoate Traditional Name: 2,2,3-trimethylpelargonic acid (2-hydroxy-1-methylol-ethyl) ester Formula: C15H30O4 MolecularWeight: 274.3963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H30O4/c1-5-6-7-8-9-12(2)15(3,4)14(18)19-13(10-16)11-17/h12-13,16-17H,5-11H2,1-4H3