5-(4-methylpiperidin-1-yl)-1-(3-oxidanylidene-3-piperazin-4-ium-1-yl-propyl)pyridin-2-one

Systemtic Name: 5-(4-methylpiperidin-1-yl)-1-(3-oxidanylidene-3-piperazin-4-ium-1-yl-propyl)pyridin-2-one Openeye Name: 5-(4-methyl-1-piperidyl)-1-(3-oxo-3-piperazin-4-ium-1-yl-propyl)pyridin-2-one CAS Name: 5-(4-methyl-1-piperidinyl)-1-[3-oxo-3-(1-piperazin-4-iumyl)propyl]-2-pyridinone IUPAC Name: 5-(4-methylpiperidin-1-yl)-1-(3-oxo-3-piperazin-4-ium-1-ylpropyl)pyridin-2-one Traditional Name: 1-(3-keto-3-piperazin-4-ium-1-yl-propyl)-5-(4-methylpiperidino)-2-pyridone Formula: C18H29N4O2+ MolecularWeight: 333.44846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CN(C(=O)C=C2)CCC(=O)N3CC[NH2+]CC3

Isomeric SMILES

CC1CCN(CC1)C2=CN(C(=O)C=C2)CCC(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C18H28N4O2/c1-15-4-9-20(10-5-15)16-2-3-17(23)22(14-16)11-6-18(24)21-12-7-19-8-13-21/h2-3,14-15,19H,4-13H2,1H3/p+1