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

Systemtic Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)ethanamide chloride Openeye Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)acetamide chloride CAS Name: 2-(2,3,4,5,6-pentadeuterio-1-pyridin-1-iumyl)acetamide chloride IUPAC Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)acetamide chloride Traditional Name: 2-(2,3,4,5,6-pentadeuteriopyridin-1-ium-1-yl)acetamide chloride Formula: C7H9ClN2O MolecularWeight: 177.642969

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(=O)N.[Cl-]

Isomeric SMILES

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

InChI

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