7-azido-3-methyl-2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one

Systemtic Name: 7-azido-3-methyl-2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Openeye Name: 7-azido-3-methyl-2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one CAS Name: 7-azido-3-methyl-2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one IUPAC Name: 7-azido-3-methyl-2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Traditional Name: 7-azido-3-methyl-2-phosphonato-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Formula: C7H7N4O4PS-2 MolecularWeight: 274.193641

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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)/p-2