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

Systemtic Name: 8-oxidanylidene-3-(pyridin-4-ylmethoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 8-oxo-3-(4-pyridylmethoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 8-oxo-3-(pyridin-4-ylmethoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 8-oxo-3-(pyridin-4-ylmethoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-3-(4-pyridylmethoxy)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H12N2O4S MolecularWeight: 292.31038

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=C(CS2)OCC3=CC=NC=C3)C(=O)O

Isomeric SMILES

C1C2N(C1=O)C(=C(CS2)OCC3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C13H12N2O4S/c16-10-5-11-15(10)12(13(17)18)9(7-20-11)19-6-8-1-3-14-4-2-8/h1-4,11H,5-7H2,(H,17,18)