methyl 2-ethanoylheptanoate

Systemtic Name: methyl 2-ethanoylheptanoate Openeye Name: methyl 2-acetylheptanoate CAS Name: 2-acetylheptanoic acid methyl ester IUPAC Name: methyl 2-acetylheptanoate Traditional Name: 2-acetylenanthic acid methyl ester Formula: C10H18O3 MolecularWeight: 186.24812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H18O3/c1-4-5-6-7-9(8(2)11)10(12)13-3/h9H,4-7H2,1-3H3