7-azanyl-3-(oxan-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-(oxan-2-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-8-oxo-3-tetrahydropyran-2-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-(2-oxanyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-(oxan-2-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-8-keto-3-tetrahydropyran-2-yl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)C2=C(N3C(C(C3=O)N)SC2)C(=O)O

Isomeric SMILES

C1CCOC(C1)C2=C(N3C(C(C3=O)N)SC2)C(=O)O

InChI

InChI=1S/C12H16N2O4S/c13-8-10(15)14-9(12(16)17)6(5-19-11(8)14)7-3-1-2-4-18-7/h7-8,11H,1-5,13H2,(H,16,17)