(3-oxidanyl-4-oxidanylidene-nonan-2-yl) ethanoate

Systemtic Name: (3-oxidanyl-4-oxidanylidene-nonan-2-yl) ethanoate Openeye Name: (2-hydroxy-1-methyl-3-oxo-octyl) acetate CAS Name: acetic acid (3-hydroxy-4-oxononan-2-yl) ester IUPAC Name: (3-hydroxy-4-oxononan-2-yl) acetate Traditional Name: acetic acid (2-hydroxy-3-keto-1-methyl-octyl) ester Formula: C11H20O4 MolecularWeight: 216.2741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H20O4/c1-4-5-6-7-10(13)11(14)8(2)15-9(3)12/h8,11,14H,4-7H2,1-3H3