diethyl 2-(1,1,2,2,3,3,3-heptadeuteriopropyl)-2-prop-2-enyl-propanedioate

Systemtic Name: diethyl 2-(1,1,2,2,3,3,3-heptadeuteriopropyl)-2-prop-2-enyl-propanedioate Openeye Name: diethyl 2-allyl-2-(1,1,2,2,3,3,3-heptadeuteriopropyl)propanedioate CAS Name: 2-(1,1,2,2,3,3,3-heptadeuteriopropyl)-2-prop-2-enylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-(1,1,2,2,3,3,3-heptadeuteriopropyl)-2-prop-2-enylpropanedioate Traditional Name: 2-allyl-2-(1,1,2,2,3,3,3-heptadeuteriopropyl)malonic acid diethyl ester Formula: C13H22O4 MolecularWeight: 249.354512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22O4/c1-5-9-13(10-6-2,11(14)16-7-3)12(15)17-8-4/h5H,1,6-10H2,2-4H3/i2D3,6D2,10D2