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

Systemtic Name: 3-ethylsulfanyl-6-(hydroxymethyl)-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: 3-ethylsulfanyl-6-(hydroxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: 3-(ethylthio)-6-(hydroxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: 3-ethylsulfanyl-6-(hydroxymethyl)-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: 3-(ethylthio)-7-keto-6-methylol-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C9H11NO4S2 MolecularWeight: 261.31794

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N2C(S1)C(C2=O)CO)C(=O)O

Isomeric SMILES

CCSC1=C(N2C(S1)C(C2=O)CO)C(=O)O

InChI

InChI=1S/C9H11NO4S2/c1-2-15-9-5(8(13)14)10-6(12)4(3-11)7(10)16-9/h4,7,11H,2-3H2,1H3,(H,13,14)