(7-azido-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl)phosphonic acid

Systemtic Name: (7-azido-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl)phosphonic acid Openeye Name: (7-azido-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl)phosphonic acid CAS Name: (7-azido-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl)phosphonic acid IUPAC Name: (7-azido-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl)phosphonic acid Traditional Name: (7-azido-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl)phosphonic acid Formula: C7H9N4O4PS MolecularWeight: 276.209521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)N=[N+]=[N-])SC1)P(=O)(O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)N=[N+]=[N-])SC1)P(=O)(O)O

InChI

InChI=1S/C7H9N4O4PS/c1-3-2-17-7-4(9-10-8)5(12)11(7)6(3)16(13,14)15/h4,7H,2H2,1H3,(H2,13,14,15)