2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)ethanamide

Systemtic Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)ethanamide Openeye Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)acetamide CAS Name: 2-(2,3,4,5,6-pentadeuterio-1-pyridin-1-iumyl)acetamide IUPAC Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)acetamide Traditional Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)acetamide Formula: C7H9N2O+ MolecularWeight: 142.189969

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C7H8N2O/c8-7(10)6-9-4-2-1-3-5-9/h1-5H,6H2,(H-,8,10)/p+1/i1D,2D,3D,4D,5D