3,6-diethyl-4-oxidanidyl-1-oxidanyl-pyrazin-4-ium-2-one

Systemtic Name: 3,6-diethyl-4-oxidanidyl-1-oxidanyl-pyrazin-4-ium-2-one Openeye Name: 3,6-diethyl-1-hydroxy-4-oxido-pyrazin-4-ium-2-one CAS Name: 3,6-diethyl-1-hydroxy-4-oxido-2-pyrazin-4-iumone IUPAC Name: 3,6-diethyl-1-hydroxy-4-oxidopyrazin-4-ium-2-one Traditional Name: 3,6-diethyl-1-hydroxy-4-oxido-pyrazin-4-ium-2-one Formula: C8H12N2O3 MolecularWeight: 184.19248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=C(C(=O)N1O)CC)[O-]

Isomeric SMILES

CCC1=C[N+](=C(C(=O)N1O)CC)[O-]

InChI

InChI=1S/C8H12N2O3/c1-3-6-5-9(12)7(4-2)8(11)10(6)13/h5,13H,3-4H2,1-2H3