4-oxidanylidenenonan-2-yl 2-oxidanylpropanoate

Systemtic Name: 4-oxidanylidenenonan-2-yl 2-oxidanylpropanoate Openeye Name: (1-methyl-3-oxo-octyl) 2-hydroxypropanoate CAS Name: 2-hydroxypropanoic acid 4-oxononan-2-yl ester IUPAC Name: 4-oxononan-2-yl 2-hydroxypropanoate Traditional Name: 2-hydroxypropionic acid (3-keto-1-methyl-octyl) ester Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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