ethyl 2-ethanoyl-4-methyl-heptanoate

Systemtic Name: ethyl 2-ethanoyl-4-methyl-heptanoate Openeye Name: ethyl 2-acetyl-4-methyl-heptanoate CAS Name: 2-acetyl-4-methylheptanoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-4-methylheptanoate Traditional Name: 2-acetyl-4-methyl-enanthic acid ethyl ester Formula: C12H22O3 MolecularWeight: 214.30128

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(C(=O)C)C(=O)OCC

Isomeric SMILES

CCCC(C)CC(C(=O)C)C(=O)OCC

InChI

InChI=1S/C12H22O3/c1-5-7-9(3)8-11(10(4)13)12(14)15-6-2/h9,11H,5-8H2,1-4H3