sodium 6-(1-hydroxyethyl)-7-oxidanylidene-3-(4-oxidanyloxolan-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium 6-(1-hydroxyethyl)-7-oxidanylidene-3-(4-oxidanyloxolan-3-yl)sulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium 6-(1-hydroxyethyl)-3-(4-hydroxytetrahydrofuran-3-yl)sulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium 6-(1-hydroxyethyl)-3-[(4-hydroxy-3-oxolanyl)thio]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium 6-(1-hydroxyethyl)-3-(4-hydroxyoxolan-3-yl)sulfanyl-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium 6-(1-hydroxyethyl)-3-[(4-hydroxytetrahydrofuran-3-yl)thio]-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C12H14NNaO6S2 MolecularWeight: 355.36243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2N(C1=O)C(=C(S2)SC3COCC3O)C(=O)[O-])O.[Na+]

Isomeric SMILES

CC(C1C2N(C1=O)C(=C(S2)SC3COCC3O)C(=O)[O-])O.[Na+]

InChI

InChI=1S/C12H15NO6S2.Na/c1-4(14)7-9(16)13-8(11(17)18)12(21-10(7)13)20-6-3-19-2-5(6)15;/h4-7,10,14-15H,2-3H2,1H3,(H,17,18);/q;+1/p-1