ethyl 2-ethyl-2-oxidanyl-3-oxidanylidene-pentanoate

Systemtic Name: ethyl 2-ethyl-2-oxidanyl-3-oxidanylidene-pentanoate Openeye Name: ethyl 2-ethyl-2-hydroxy-3-oxo-pentanoate CAS Name: 2-ethyl-2-hydroxy-3-oxopentanoic acid ethyl ester IUPAC Name: ethyl 2-ethyl-2-hydroxy-3-oxopentanoate Traditional Name: 2-ethyl-2-hydroxy-3-keto-valeric acid ethyl ester Formula: C9H16O4 MolecularWeight: 188.22094

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC)(C(=O)OCC)O

Isomeric SMILES

CCC(=O)C(CC)(C(=O)OCC)O

InChI

InChI=1S/C9H16O4/c1-4-7(10)9(12,5-2)8(11)13-6-3/h12H,4-6H2,1-3H3