Chem
J-GLOBAL ID:200907057617183074
Nikkaji number:J1.578.303F
8α-Hydroxy-8-(1-methyl-1H-pyrrole-2-yl)bicyclo[4.2.0]octa-1,3,5-triene-7-one
8α-ヒドロキシ-8-(1-メチル-1H-ピロール-2-イル)ビシクロ[4.2.0]オクタ-1,3,5-トリエン-7-オン
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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 H11 NO2
Molecular formula furigana:
C13-H11-N-O2
Molecular weight:
213.236
InChI:
InChI=1S/C13H11NO2/c1-14-8-4-7-11(14)13(16)10-6-3-2-5-9(10)12(13)15/h2-8,16H,1H3/t13-/m0/s1
InChI key:
HRBOQFBZIYQIKX-ZDUSSCGKSA-N
SMILES:
Cn1cccc1[C@]1(O)C(=O)c2ccccc12
Systematic name (3):
8α-ヒドロキシ-8-(1-メチル-1H-ピロール-2-イル)ビシクロ[4.2.0]オクタ-1,3,5-トリエン-7-オン
(8S)-8-ヒドロキシ-8-(1-メチル-1H-ピロール-2-イル)ビシクロ[4.2.0]オクタ-1,3,5-トリエン-7-オン
(8S)-8-hydroxy-8-(1-methyl-1H-pyrrol-2-yl)bicyclo[4.2.0]octa-1,3,5-trien-7-one
Other name (1):
8α-Hydroxy-8-(1-methyl-1H-pyrrole-2-yl)bicyclo[4.2.0]octa-1,3,5-triene-7-one
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