3-(hydroxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid

Systemtic Name: 3-(hydroxymethyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid Openeye Name: 3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid CAS Name: 3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid IUPAC Name: 3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid Traditional Name: 8-keto-3-methylol-5-thia-1-azabicyclo[4.2.0]oct-2-ene-4-carboxylic acid Formula: C8H9NO4S MolecularWeight: 215.22636

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C=C(C(S2)C(=O)O)CO

Isomeric SMILES

C1C2N(C1=O)C=C(C(S2)C(=O)O)CO

InChI

InChI=1S/C8H9NO4S/c10-3-4-2-9-5(11)1-6(9)14-7(4)8(12)13/h2,6-7,10H,1,3H2,(H,12,13)