6-piperidin-1-ium-4-yl-2-(2-pyridin-2-ylethyl)-1H-pyrimidin-4-one

Systemtic Name: 6-piperidin-1-ium-4-yl-2-(2-pyridin-2-ylethyl)-1H-pyrimidin-4-one Openeye Name: 6-piperidin-1-ium-4-yl-2-[2-(2-pyridyl)ethyl]-1H-pyrimidin-4-one CAS Name: 6-(4-piperidin-1-iumyl)-2-[2-(2-pyridinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 6-piperidin-1-ium-4-yl-2-(2-pyridin-2-ylethyl)-1H-pyrimidin-4-one Traditional Name: 6-piperidin-1-ium-4-yl-2-[2-(2-pyridyl)ethyl]-1H-pyrimidin-4-one Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C2=CC(=O)N=C(N2)CCC3=CC=CC=N3

Isomeric SMILES

C1C[NH2+]CCC1C2=CC(=O)N=C(N2)CCC3=CC=CC=N3

InChI

InChI=1S/C16H20N4O/c21-16-11-14(12-6-9-17-10-7-12)19-15(20-16)5-4-13-3-1-2-8-18-13/h1-3,8,11-12,17H,4-7,9-10H2,(H,19,20,21)/p+1