4-methyl-1-(3-oxidanylidene-3-piperazin-4-ium-1-yl-propyl)pyridin-2-one

Systemtic Name: 4-methyl-1-(3-oxidanylidene-3-piperazin-4-ium-1-yl-propyl)pyridin-2-one Openeye Name: 4-methyl-1-(3-oxo-3-piperazin-4-ium-1-yl-propyl)pyridin-2-one CAS Name: 4-methyl-1-[3-oxo-3-(1-piperazin-4-iumyl)propyl]-2-pyridinone IUPAC Name: 4-methyl-1-(3-oxo-3-piperazin-4-ium-1-ylpropyl)pyridin-2-one Traditional Name: 1-(3-keto-3-piperazin-4-ium-1-yl-propyl)-4-methyl-2-pyridone Formula: C13H20N3O2+ MolecularWeight: 250.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C=C1)CCC(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC1=CC(=O)N(C=C1)CCC(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C13H19N3O2/c1-11-2-6-15(13(18)10-11)7-3-12(17)16-8-4-14-5-9-16/h2,6,10,14H,3-5,7-9H2,1H3/p+1