Chem
J-GLOBAL ID：200907076260692026   Nikkaji number：J2.643.151D

[(1α,5α,2Z)-6,7-Bis(methoxycarbonyl)-8-benzyl-8-azabicyclo[3.2.1]octa-6-ene-2-ylidene]acetic acid ethyl ester

[(1α,5α,2Z)-6,7-ビス(メトキシカルボニル)-8-ベンジル-8-アザビシクロ[3.2.1]オクタ-6-エン-2-イリデン]酢酸エチル
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： C22H25NO6
Molecular formula furigana： C22-H25-N-O6
Molecular weight： 399.443
InChI： InChI=1S/C22H25NO6/c1-4-29-17(24)12-15-10-11-16-18(21(25)27-2)19(22(26)28-3)20(15)23(16)13-14-8-6-5-7-9-14/h5-9,12,16,20H,4,10-11,13H2,1-3H3/b15-12-/t16-,20+/m0/s1
InChI key： NRIWSSDADZUUQA-YGSZSEMYSA-N
SMILES： CCOC(=O)/C=C\1/CC[C@@H]2N(Cc3ccccc3)[C@H]1C(=C2C(=O)OC)C(=O)OC
Systematic name  (3)：
  • [(1α,5α,2Z)-6,7-ビス(メトキシカルボニル)-8-ベンジル-8-アザビシクロ[3.2.1]オクタ-6-エン-2-イリデン]酢酸エチル
  • 6,7-ジメチル (1R,2Z,5S)-8-ベンジル-2-(2-エトキシ-2-オキソエチリデン)-8-アザビシクロ[3.2.1]オクタ-6-エン-6,7-ジカルボキシラート
  • 6,7-dimethyl (1R,2Z,5S)-8-benzyl-2-(2-ethoxy-2-oxoethylidene)-8-azabicyclo[3.2.1]oct-6-ene-6,7-dicarboxylate
Other name (1)：
  • [(1α,5α,2Z)-6,7-Bis(methoxycarbonyl)-8-benzyl-8-azabicyclo[3.2.1]octa-6-ene-2-ylidene]acetic acid ethyl ester
Thsaurus map：
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