methyl 2-ethanoylhexanoate

Systemtic Name: methyl 2-ethanoylhexanoate Openeye Name: methyl 2-acetylhexanoate CAS Name: 2-acetylhexanoic acid methyl ester IUPAC Name: methyl 2-acetylhexanoate Traditional Name: 2-acetylhexanoic acid methyl ester Formula: C9H16O3 MolecularWeight: 172.22154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H16O3/c1-4-5-6-8(7(2)10)9(11)12-3/h8H,4-6H2,1-3H3