3-methyl-1-(5-oxidanylidene-5-piperazin-4-ium-1-yl-pentyl)pyridin-2-one

Systemtic Name: 3-methyl-1-(5-oxidanylidene-5-piperazin-4-ium-1-yl-pentyl)pyridin-2-one Openeye Name: 3-methyl-1-(5-oxo-5-piperazin-4-ium-1-yl-pentyl)pyridin-2-one CAS Name: 3-methyl-1-[5-oxo-5-(1-piperazin-4-iumyl)pentyl]-2-pyridinone IUPAC Name: 3-methyl-1-(5-oxo-5-piperazin-4-ium-1-ylpentyl)pyridin-2-one Traditional Name: 1-(5-keto-5-piperazin-4-ium-1-yl-pentyl)-3-methyl-2-pyridone Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN(C1=O)CCCCC(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC1=CC=CN(C1=O)CCCCC(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C15H23N3O2/c1-13-5-4-10-18(15(13)20)9-3-2-6-14(19)17-11-7-16-8-12-17/h4-5,10,16H,2-3,6-9,11-12H2,1H3/p+1