Pyridinium, 1-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, iodide (1:1)

CAS Registry Number®

100988-63-4

CAS Name

Pyridinium, 1-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, iodide (1:1)

Molecular Formula

C13H14N3O3S.I

Cite this Page

Pyridinium, 1-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, iodide (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=100988-63-4 (retrieved 2024-11-25) (CAS RN: 100988-63-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H13N3O3S.HI/c14-9-11(17)16-10(13(18)19)8(7-20-12(9)16)6-15-4-2-1-3-5-15;/h1-5,9,12H,6-7,14H2;1H/t9-,12-;/m1./s1

InChIKey

InChIKey=SZYIIYPUOUTNDY-WYUVZMMLSA-N

SMILES

C(O)(=O)C=1N2[C@@]([C@H](N)C2=O)(SCC1C[N+]=3C=CC=CC3)[H].[I-]

Canonical SMILES

[I-].O=C(O)C1=C(CSC2N1C(=O)C2N)C[N+]=3C=CC=CC3

Other Names for this Substance

  • Pyridinium, 1-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, iodide (1:1)
  • Pyridinium, 1-[(7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl)methyl]-, iodide, (6R-trans)-
  • Pyridinium, 1-[[(6R,7R)-7-amino-2-carboxy-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl]-, iodide

Deleted or Replaced CAS Registry Numbers

105459-61-8, 106937-15-9

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