5-(1,4-diazepan-4-ium-1-ylcarbonyl)-1H-pyrazin-2-one

Systemtic Name: 5-(1,4-diazepan-4-ium-1-ylcarbonyl)-1H-pyrazin-2-one Openeye Name: 5-(1,4-diazepan-4-ium-1-carbonyl)-1H-pyrazin-2-one CAS Name: 5-[1,4-diazepan-4-ium-1-yl(oxo)methyl]-1H-pyrazin-2-one IUPAC Name: 5-(1,4-diazepan-4-ium-1-carbonyl)-1H-pyrazin-2-one Traditional Name: 5-(1,4-diazepan-4-ium-1-carbonyl)-1H-pyrazin-2-one Formula: C10H15N4O2+ MolecularWeight: 223.2517

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C(=O)C2=CNC(=O)C=N2

Isomeric SMILES

C1C[NH2+]CCN(C1)C(=O)C2=CNC(=O)C=N2

InChI

InChI=1S/C10H14N4O2/c15-9-7-12-8(6-13-9)10(16)14-4-1-2-11-3-5-14/h6-7,11H,1-5H2,(H,13,15)/p+1