3-(1,4-diazepan-4-ium-1-ylcarbonyl)-1H-pyridin-2-one

Systemtic Name: 3-(1,4-diazepan-4-ium-1-ylcarbonyl)-1H-pyridin-2-one Openeye Name: 3-(1,4-diazepan-4-ium-1-carbonyl)-1H-pyridin-2-one CAS Name: 3-[1,4-diazepan-4-ium-1-yl(oxo)methyl]-1H-pyridin-2-one IUPAC Name: 3-(1,4-diazepan-4-ium-1-carbonyl)-1H-pyridin-2-one Traditional Name: 3-(1,4-diazepan-4-ium-1-carbonyl)-2-pyridone Formula: C11H16N3O2+ MolecularWeight: 222.26364

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C(=O)C2=CC=CNC2=O

Isomeric SMILES

C1C[NH2+]CCN(C1)C(=O)C2=CC=CNC2=O

InChI

InChI=1S/C11H15N3O2/c15-10-9(3-1-5-13-10)11(16)14-7-2-4-12-6-8-14/h1,3,5,12H,2,4,6-8H2,(H,13,15)/p+1