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

Systemtic Name: 4-methyl-1-(4-oxidanylidene-4-piperazin-4-ium-1-yl-butyl)pyridin-2-one Openeye Name: 4-methyl-1-(4-oxo-4-piperazin-4-ium-1-yl-butyl)pyridin-2-one CAS Name: 4-methyl-1-[4-oxo-4-(1-piperazin-4-iumyl)butyl]-2-pyridinone IUPAC Name: 4-methyl-1-(4-oxo-4-piperazin-4-ium-1-ylbutyl)pyridin-2-one Traditional Name: 1-(4-keto-4-piperazin-4-ium-1-yl-butyl)-4-methyl-2-pyridone Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2/c1-12-4-8-16(14(19)11-12)7-2-3-13(18)17-9-5-15-6-10-17/h4,8,11,15H,2-3,5-7,9-10H2,1H3/p+1