(9-methyl-3-oxidanylidene-decan-4-yl) ethanoate

Systemtic Name: (9-methyl-3-oxidanylidene-decan-4-yl) ethanoate Openeye Name: (6-methyl-1-propanoyl-heptyl) acetate CAS Name: acetic acid (9-methyl-3-oxodecan-4-yl) ester IUPAC Name: (9-methyl-3-oxodecan-4-yl) acetate Traditional Name: acetic acid (6-methyl-1-propionyl-heptyl) ester Formula: C13H24O3 MolecularWeight: 228.32786

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCC(C)C)OC(=O)C

Isomeric SMILES

CCC(=O)C(CCCCC(C)C)OC(=O)C

InChI

InChI=1S/C13H24O3/c1-5-12(15)13(16-11(4)14)9-7-6-8-10(2)3/h10,13H,5-9H2,1-4H3