6-(2-hydroxyethyl)-3-(hydroxymethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: 6-(2-hydroxyethyl)-3-(hydroxymethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 6-(2-hydroxyethyl)-3-(hydroxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 6-(2-hydroxyethyl)-3-(hydroxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 6-(2-hydroxyethyl)-3-(hydroxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 6-(2-hydroxyethyl)-7-keto-3-methylol-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C9H11NO5S MolecularWeight: 245.25234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO5S/c11-2-1-4-7(13)10-6(9(14)15)5(3-12)16-8(4)10/h4,8,11-12H,1-3H2,(H,14,15)