diethyl 2-(3-oxidanylidenebutyl)-2-(1,1,2,2,2-pentadeuterioethyl)propanedioate

Systemtic Name: diethyl 2-(3-oxidanylidenebutyl)-2-(1,1,2,2,2-pentadeuterioethyl)propanedioate Openeye Name: diethyl 2-(3-oxobutyl)-2-(1,1,2,2,2-pentadeuterioethyl)propanedioate CAS Name: 2-(3-oxobutyl)-2-(1,1,2,2,2-pentadeuterioethyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(3-oxobutyl)-2-(1,1,2,2,2-pentadeuterioethyl)propanedioate Traditional Name: 2-(3-ketobutyl)-2-(1,1,2,2,2-pentadeuterioethyl)malonic acid diethyl ester Formula: C13H22O5 MolecularWeight: 263.341589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C([2H])([2H])C([2H])([2H])C(CCC(=O)C)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C13H22O5/c1-5-13(9-8-10(4)14,11(15)17-6-2)12(16)18-7-3/h5-9H2,1-4H3/i1D3,5D2