3-[(4-azanyl-3-oxidanylidene-1,2-oxazolidin-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-[(4-azanyl-3-oxidanylidene-1,2-oxazolidin-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-[(4-amino-3-oxo-isoxazolidin-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-[(4-amino-3-oxo-2-isoxazolidinyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-[(4-amino-3-oxo-1,2-oxazolidin-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-[(4-amino-3-keto-isoxazolidin-2-yl)methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C11H13N3O5S MolecularWeight: 299.30302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)C(=C(CS2)CN3C(=O)C(CO3)N)C(=O)O

Isomeric SMILES

C1C2N(C1=O)C(=C(CS2)CN3C(=O)C(CO3)N)C(=O)O

InChI

InChI=1S/C11H13N3O5S/c12-6-3-19-13(10(6)16)2-5-4-20-8-1-7(15)14(8)9(5)11(17)18/h6,8H,1-4,12H2,(H,17,18)