Chem
J-GLOBAL ID:200907011941772880
Nikkaji number:J1.701.209F
(1R,10R)-2-Oxo-3-oxatricyclo[8.1.0.04,9 ]undecane-4,6,8-triene-1-carboxylic acid ethyl ester
(1R,10R)-2-オキソ-3-オキサトリシクロ[8.1.0.04,9 ]ウンデカン-4,6,8-トリエン-1-カルボン酸エチル
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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:
C13 H12 O4
Molecular formula furigana:
C13-H12-O4
Molecular weight:
232.235
InChI:
InChI=1S/C13H12O4/c1-2-16-11(14)13-7-9(13)8-5-3-4-6-10(8)17-12(13)15/h3-6,9H,2,7H2,1H3/t9-,13-/m1/s1
InChI key:
SWNPFTUGPNIKMX-NOZJJQNGSA-N
SMILES:
CCOC(=O)[C@@]12C[C@@H]1c1ccccc1OC2=O
Systematic name (3):
(1R,10R)-2-オキソ-3-オキサトリシクロ[8.1.0.04,9 ]ウンデカン-4,6,8-トリエン-1-カルボン酸エチル
エチル (2R,4R)-5-オキソ-6-オキサトリシクロ[5.4.0.02,4 ]ウンデカ-1(11),7,9-トリエン-4-カルボキシラート
ethyl (2R,4R)-5-oxo-6-oxatricyclo[5.4.0.02,4 ]undeca-1(11),7,9-triene-4-carboxylate
Other name (1):
(1R,10R)-2-Oxo-3-oxatricyclo[8.1.0.04,9 ]undecane-4,6,8-triene-1-carboxylic acid ethyl ester
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