7-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate iodide

Systemtic Name: 7-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate iodide Openeye Name: 7-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate iodide CAS Name: 7-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate iodide IUPAC Name: 7-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate iodide Traditional Name: 8-keto-7-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate iodide Formula: C8H8INO3S-2 MolecularWeight: 325.12349

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2N(C1=O)C(=CCS2)C(=O)[O-].[I-]

Isomeric SMILES

CC1C2N(C1=O)C(=CCS2)C(=O)[O-].[I-]

InChI

InChI=1S/C8H9NO3S.HI/c1-4-6(10)9-5(8(11)12)2-3-13-7(4)9;/h2,4,7H,3H2,1H3,(H,11,12);1H/p-2