(7E)-8-oxidanylidene-7-(pyridin-2-ylmethylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: (7E)-8-oxidanylidene-7-(pyridin-2-ylmethylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: (7E)-8-oxo-7-(2-pyridylmethylene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: (7E)-8-oxo-7-(2-pyridinylmethylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: (7E)-8-oxo-7-(pyridin-2-ylmethylidene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: (7E)-8-keto-7-(2-pyridylmethylene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H10N2O3S MolecularWeight: 274.2951

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C(S1)C(=CC3=CC=CC=N3)C2=O)C(=O)O

Isomeric SMILES

C1C=C(N2C(S1)/C(=C/C3=CC=CC=N3)/C2=O)C(=O)O

InChI

InChI=1S/C13H10N2O3S/c16-11-9(7-8-3-1-2-5-14-8)12-15(11)10(13(17)18)4-6-19-12/h1-5,7,12H,6H2,(H,17,18)/b9-7+