3-acetyloxynonyl ethanoate; nonane-1,3-diol

Systemtic Name: 3-acetyloxynonyl ethanoate; nonane-1,3-diol Openeye Name: 3-acetoxynonyl acetate; nonane-1,3-diol CAS Name: acetic acid 3-acetyloxynonyl ester; nonane-1,3-diol IUPAC Name: 3-acetyloxynonyl acetate; nonane-1,3-diol Traditional Name: acetic acid 3-acetoxynonyl ester; nonane-1,3-diol Formula: C22H44O6 MolecularWeight: 404.58116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCO)O.CCCCCCC(CCOC(=O)C)OC(=O)C

Isomeric SMILES

CCCCCCC(CCO)O.CCCCCCC(CCOC(=O)C)OC(=O)C

InChI

InChI=1S/C13H24O4.C9H20O2/c1-4-5-6-7-8-13(17-12(3)15)9-10-16-11(2)14;1-2-3-4-5-6-9(11)7-8-10/h13H,4-10H2,1-3H3;9-11H,2-8H2,1H3