methyl 2-(2,4,5-trideuterioimidazol-1-yl)ethanoate

Systemtic Name: methyl 2-(2,4,5-trideuterioimidazol-1-yl)ethanoate Openeye Name: methyl 2-(2,4,5-trideuterioimidazol-1-yl)acetate CAS Name: 2-(2,4,5-trideuterio-1-imidazolyl)acetic acid methyl ester IUPAC Name: methyl 2-(2,4,5-trideuterioimidazol-1-yl)acetate Traditional Name: 2-(2,4,5-trideuterioimidazol-1-yl)acetic acid methyl ester Formula: C6H8N2O2 MolecularWeight: 143.158405

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C=CN=C1

Isomeric SMILES

[2H]C1=C(N(C(=N1)[2H])CC(=O)OC)[2H]

InChI

InChI=1S/C6H8N2O2/c1-10-6(9)4-8-3-2-7-5-8/h2-3,5H,4H2,1H3/i2D,3D,5D