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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)CCCN2C=CC=CC2=O

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)CCCN2C=CC=CC2=O

InChI

InChI=1S/C13H19N3O2/c17-12-4-1-2-8-15(12)9-3-5-13(18)16-10-6-14-7-11-16/h1-2,4,8,14H,3,5-7,9-11H2/p+1