diethyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate

Systemtic Name: diethyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate Openeye Name: diethyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate CAS Name: 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylate Traditional Name: 3,4,5,6-tetradeuteriobenzene-1,2-dicarboxylic acid diethyl ester Formula: C12H14O4 MolecularWeight: 226.261807

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1C(=O)OCC

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[2H])C(=O)OCC)C(=O)OCC)[2H])[2H]

InChI

InChI=1S/C12H14O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h5-8H,3-4H2,1-2H3/i5D,6D,7D,8D