7-(oxan-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-(oxan-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 8-oxo-7-tetrahydropyran-2-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-(2-oxanyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-(oxan-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-tetrahydropyran-2-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)C2C3N(C2=O)C(=CCS3)C(=O)O

Isomeric SMILES

C1CCOC(C1)C2C3N(C2=O)C(=CCS3)C(=O)O

InChI

InChI=1S/C12H15NO4S/c14-10-9(8-3-1-2-5-17-8)11-13(10)7(12(15)16)4-6-18-11/h4,8-9,11H,1-3,5-6H2,(H,15,16)