5-ethyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-oxidanidyl-pyrazin-4-ium-2-one

Systemtic Name: 5-ethyl-1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-oxidanidyl-pyrazin-4-ium-2-one Openeye Name: 5-ethyl-1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-oxido-pyrazin-4-ium-2-one CAS Name: 5-ethyl-1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-oxido-2-pyrazin-4-iumone IUPAC Name: 5-ethyl-1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxidopyrazin-4-ium-2-one Traditional Name: 5-ethyl-1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-4-oxido-pyrazin-4-ium-2-one Formula: C11H16N2O5 MolecularWeight: 256.25514

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=O)C=[N+]1[O-])C2CC(C(O2)CO)O

Isomeric SMILES

CCC1=CN(C(=O)C=[N+]1[O-])C2CC(C(O2)CO)O

InChI

InChI=1S/C11H16N2O5/c1-2-7-4-12(10(16)5-13(7)17)11-3-8(15)9(6-14)18-11/h4-5,8-9,11,14-15H,2-3,6H2,1H3