N-[1-[1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl]pyridin-1-ium-4-yl]ethanamide bromide

Systemtic Name: N-[1-[1-(4-chlorophenyl)-1-oxidanylidene-propan-2-yl]pyridin-1-ium-4-yl]ethanamide bromide Openeye Name: N-[1-[2-(4-chlorophenyl)-1-methyl-2-oxo-ethyl]pyridin-1-ium-4-yl]acetamide bromide CAS Name: N-[1-[1-(4-chlorophenyl)-1-oxopropan-2-yl]-4-pyridin-1-iumyl]acetamide bromide IUPAC Name: N-[1-[1-(4-chlorophenyl)-1-oxopropan-2-yl]pyridin-1-ium-4-yl]acetamide bromide Traditional Name: N-[1-[2-(4-chlorophenyl)-2-keto-1-methyl-ethyl]pyridin-1-ium-4-yl]acetamide bromide Formula: C16H16BrClN2O2 MolecularWeight: 383.66744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)Cl)[N+]2=CC=C(C=C2)NC(=O)C.[Br-]

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)Cl)[N+]2=CC=C(C=C2)NC(=O)C.[Br-]

InChI

InChI=1S/C16H15ClN2O2.BrH/c1-11(16(21)13-3-5-14(17)6-4-13)19-9-7-15(8-10-19)18-12(2)20;/h3-11H,1-2H3;1H