N-(tert-butylcarbamoyl)-2-(3-ethanoylpyridin-1-ium-1-yl)ethanamide chloride

Systemtic Name: N-(tert-butylcarbamoyl)-2-(3-ethanoylpyridin-1-ium-1-yl)ethanamide chloride Openeye Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(tert-butylcarbamoyl)acetamide chloride CAS Name: 2-(3-acetyl-1-pyridin-1-iumyl)-N-[(tert-butylamino)-oxomethyl]acetamide chloride IUPAC Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(tert-butylcarbamoyl)acetamide chloride Traditional Name: 2-(3-acetylpyridin-1-ium-1-yl)-N-(tert-butylcarbamoyl)acetamide chloride Formula: C14H20ClN3O3 MolecularWeight: 313.7799

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O3.ClH/c1-10(18)11-6-5-7-17(8-11)9-12(19)15-13(20)16-14(2,3)4;/h5-8H,9H2,1-4H3,(H-,15,16,19,20);1H