Chem
J-GLOBAL ID：201707015400389233   Nikkaji number：J3.645.339G

(3aα,3bβ,7R,8aα)-7β-Phenyloctahydro-1H-5,8-dioxa-7a-azacyclopenta[a]indene-1,4-dione 1-[(E)-O-benzyl oxime]

(1R,2S,5E,6R,9R)-5-[(ベンジルオキシ)イミノ]-9-フェニル-7,11-ジオキサ-8-アザトリシクロ[6.4.0.02,6]ドデカン-12-オン
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： C22H22N2O4
Molecular formula furigana： C22-H22-N2-O4
Molecular weight： 378.428
InChI： InChI=1S/C22H22N2O4/c25-22-20-17-11-12-18(23-27-13-15-7-3-1-4-8-15)21(17)28-24(20)19(14-26-22)16-9-5-2-6-10-16/h1-10,17,19-21H,11-14H2/b23-18+/t17-,19-,20+,21+/m0/s1
InChI key： AWDJHCCJJUKJGL-LFQALODRSA-N
SMILES： O=C1OC[C@H](N2O[C@@H]3[C@@H](CC/C/3=N\OCc3ccccc3)[C@H]12)c1ccccc1
Systematic name  (3)：
  • (3aα,3bβ,7R,8aα)-7β-フェニルオクタヒドロ-1H-5,8-ジオキサ-7a-アザシクロペンタ[a]インデン-1,4-ジオン1-[(E)-O-ベンジルオキシム]
  • (1R,2S,5E,6R,9R)-5-[(ベンジルオキシ)イミノ]-9-フェニル-7,11-ジオキサ-8-アザトリシクロ[6.4.0.02,6]ドデカン-12-オン
  • (1R,2S,5E,6R,9R)-5-[(benzyloxy)imino]-9-phenyl-7,11-dioxa-8-azatricyclo[6.4.0.02,6]dodecan-12-one
Other name (1)：
  • (3aα,3bβ,7R,8aα)-7β-Phenyloctahydro-1H-5,8-dioxa-7a-azacyclopenta[a]indene-1,4-dione 1-[(E)-O-benzyl oxime]
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