6-(hydroxymethyl)-5-methoxy-3-(2-methylpropyl)-4-oxidanidyl-1H-pyrazin-4-ium-2-one

Systemtic Name: 6-(hydroxymethyl)-5-methoxy-3-(2-methylpropyl)-4-oxidanidyl-1H-pyrazin-4-ium-2-one Openeye Name: 6-(hydroxymethyl)-3-isobutyl-5-methoxy-4-oxido-1H-pyrazin-4-ium-2-one CAS Name: 6-(hydroxymethyl)-5-methoxy-3-(2-methylpropyl)-4-oxido-1H-pyrazin-4-ium-2-one IUPAC Name: 6-(hydroxymethyl)-5-methoxy-3-(2-methylpropyl)-4-oxido-1H-pyrazin-4-ium-2-one Traditional Name: 3-isobutyl-5-methoxy-6-methylol-4-oxido-1H-pyrazin-4-ium-2-one Formula: C10H16N2O4 MolecularWeight: 228.24504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=[N+](C(=C(NC1=O)CO)OC)[O-]

Isomeric SMILES

CC(C)CC1=[N+](C(=C(NC1=O)CO)OC)[O-]

InChI

InChI=1S/C10H16N2O4/c1-6(2)4-8-9(14)11-7(5-13)10(16-3)12(8)15/h6,13H,4-5H2,1-3H3,(H,11,14)