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Substance Name: 4-Nitrobenzyl (2S-(2alpha,5alpha,6beta))-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate 4-oxide
RN: 29707-62-8
InChIKey: WNMFNGGUHIIQJE-UHFFFAOYSA-N

Molecular Formula

  • C23-H23-N3-O8-S

Molecular Weight

  • 501.514
 
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Names and Synonyms

Synonym

  • EINECS 249-792-1

Systematic Name

  • 4-Nitrobenzyl (2S-(2alpha,5alpha,6beta))-3,3-dimethyl-7-oxo-6-(phenoxyacetamido)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate 4-oxide

Registry Numbers

CAS Registry Number

  • 29707-62-8

System Generated Number

  • 0029707628

Structure Descriptors

InChI

1S/C23H23N3O8S/c1-23(2)19(22(29)34-12-14-8-10-15(11-9-14)26(30)31)25-20(28)18(21(25)35(23)32)24-17(27)13-33-16-6-4-3-5-7-16/h3-11,18-19,21H,12-13H2,1-2H3,(H,24,27)

InChIKey

WNMFNGGUHIIQJE-UHFFFAOYSA-N

Smiles

N12[C@@H]([S@@](=O)C([C@@H]1C(OCc1ccc([N+](=O)[O-])cc1)=O)(C)C)[C@@H](C2=O)NC(=O)COc1ccccc1