2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-thiophen-2-yl-ethanone chloride

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-thiophen-2-yl-ethanone chloride Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(2-thienyl)ethanone chloride CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]-1-thiophen-2-ylethanone chloride IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-thiophen-2-ylethanone chloride Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(2-thienyl)ethanone chloride Formula: C13H15ClN2OS MolecularWeight: 282.789

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=O)C2=CC=CS2.[Cl-]

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=O)C2=CC=CS2.[Cl-]

InChI

InChI=1S/C13H15N2OS.ClH/c1-14(2)11-5-7-15(8-6-11)10-12(16)13-4-3-9-17-13;/h3-9H,10H2,1-2H3;1H/q+1;/p-1