Chem
J-GLOBAL ID：200907018949805472   Nikkaji number：J1.128.194J

6-Diazopenicillanic acid tert-butyl ester

6-ジアゾペニシラン酸tert-ブチル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H17N[N-][N+]O3S
Molecular formula furigana： C12-H17-N3-O3-S
Molecular weight： 283.350
InChI： InChI=1S/C12H17N3O3S/c1-11(2,3)18-10(17)7-12(4,5)19-9-6(14-13)8(16)15(7)9/h7,9H,1-5H3/t7-,9+/m0/s1
InChI key： SAXONBQDBPDMSM-IONNQARKSA-N
SMILES： CC(C)(C)OC(=O)[C@@H]1N2[C@H](SC1(C)C)C(=[N+]=[N-])C2=O
Systematic name  (3)：
  • 6-ジアゾペニシラン酸tert-ブチル
  • tert-ブチル (2S,5R)-3,3-ジメチル-7-オキソ-6-(λ5-ジアジニリデン)-4-チア-1-アザビシクロ[3.2.0]ヘプタン-2-カルボキシラート
  • tert-butyl (2S,5R)-3,3-dimethyl-7-oxo-6-(λ5-diazynylidene)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
Other name (1)：
  • 6-Diazopenicillanic acid tert-butyl ester
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