4-[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]-4-aza-1-azoniabicyclo[3.2.2]nonane

Systemtic Name: 4-[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]-4-aza-1-azoniabicyclo[3.2.2]nonane Openeye Name: 4-[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]-4-aza-1-azoniabicyclo[3.2.2]nonane CAS Name: 4-[4-(1-methyl-4-pyrazolyl)-2-pyrimidinyl]-4-aza-1-azoniabicyclo[3.2.2]nonane IUPAC Name: 4-[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]-4-aza-1-azoniabicyclo[3.2.2]nonane Traditional Name: 4-[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]-4-aza-1-azoniabicyclo[3.2.2]nonane Formula: C15H21N6+ MolecularWeight: 285.36744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=NC=C2)N3CC[NH+]4CCC3CC4

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=NC=C2)N3CC[NH+]4CCC3CC4

InChI

InChI=1S/C15H20N6/c1-19-11-12(10-17-19)14-2-5-16-15(18-14)21-9-8-20-6-3-13(21)4-7-20/h2,5,10-11,13H,3-4,6-9H2,1H3/p+1