2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one

Systemtic Name: 2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Openeye Name: 2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one CAS Name: 2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one IUPAC Name: 2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Traditional Name: 2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Formula: C6H6NO4PS-2 MolecularWeight: 219.154901

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N2C(S1)CC2=O)P(=O)([O-])[O-]

Isomeric SMILES

C1C=C(N2C(S1)CC2=O)P(=O)([O-])[O-]

InChI

InChI=1S/C6H8NO4PS/c8-4-3-6-7(4)5(1-2-13-6)12(9,10)11/h1,6H,2-3H2,(H2,9,10,11)/p-2