[1-(1-methyl-2H-pyrazin-5-yl)-3,4-bis(oxidanyl)butan-2-yl] hydrogen sulfite

Systemtic Name: [1-(1-methyl-2H-pyrazin-5-yl)-3,4-bis(oxidanyl)butan-2-yl] hydrogen sulfite Openeye Name: [2,3-dihydroxy-1-[(1-methyl-2H-pyrazin-5-yl)methyl]propyl] hydrogen sulfite CAS Name: sulfurous acid [3,4-dihydroxy-1-(1-methyl-2H-pyrazin-5-yl)butan-2-yl] ester IUPAC Name: [3,4-dihydroxy-1-(1-methyl-2H-pyrazin-5-yl)butan-2-yl] hydrogen sulfite Traditional Name: sulfurous acid [2,3-dihydroxy-1-[(1-methyl-2H-pyrazin-5-yl)methyl]propyl] ester Formula: C9H16N2O5S MolecularWeight: 264.29874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC=NC(=C1)CC(C(CO)O)OS(=O)O

Isomeric SMILES

CN1CC=NC(=C1)CC(C(CO)O)OS(=O)O

InChI

InChI=1S/C9H16N2O5S/c1-11-3-2-10-7(5-11)4-9(8(13)6-12)16-17(14)15/h2,5,8-9,12-13H,3-4,6H2,1H3,(H,14,15)