5-(4-propylpiperazin-4-ium-1-yl)carbonyl-1H-pyridin-2-one

Systemtic Name: 5-(4-propylpiperazin-4-ium-1-yl)carbonyl-1H-pyridin-2-one Openeye Name: 5-(4-propylpiperazin-4-ium-1-carbonyl)-1H-pyridin-2-one CAS Name: 5-[oxo-(4-propyl-1-piperazin-4-iumyl)methyl]-1H-pyridin-2-one IUPAC Name: 5-(4-propylpiperazin-4-ium-1-carbonyl)-1H-pyridin-2-one Traditional Name: 5-(4-propylpiperazin-4-ium-1-carbonyl)-2-pyridone Formula: C13H20N3O2+ MolecularWeight: 250.3168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CNC(=O)C=C2

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CNC(=O)C=C2

InChI

InChI=1S/C13H19N3O2/c1-2-5-15-6-8-16(9-7-15)13(18)11-3-4-12(17)14-10-11/h3-4,10H,2,5-9H2,1H3,(H,14,17)/p+1