1-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 1-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]ethanone CAS Name: 1-[4-(2,6-dimethyl-4-pyrimidin-3-iumyl)-1-piperazinyl]ethanone IUPAC Name: 1-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(2,6-dimethylpyrimidin-3-ium-4-yl)piperazino]ethanone Formula: C12H19N4O+ MolecularWeight: 235.30546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)C)N2CCN(CC2)C(=O)C

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)C)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C12H18N4O/c1-9-8-12(14-10(2)13-9)16-6-4-15(5-7-16)11(3)17/h8H,4-7H2,1-3H3/p+1