Chem
J-GLOBAL ID:200907079439781799
Nikkaji number:J2.546.276I
(3aR)-2-Oxo-3a-propyl-4-methylene-3,3a,4,5,6,7-hexahydro-2H-indene-1-carboxylic acid methyl ester
(3aR)-2-オキソ-3a-プロピル-4-メチレン-3,3a,4,5,6,7-ヘキサヒドロ-2H-インデン-1-カルボン酸メチル
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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:
C15 H20 O3
Molecular formula furigana:
C15-H20-O3
Molecular weight:
248.322
InChI:
InChI=1S/C15H20O3/c1-4-8-15-9-12(16)13(14(17)18-3)11(15)7-5-6-10(15)2/h2,4-9H2,1,3H3/t15-/m1/s1
InChI key:
VYBVAAGVOKKGLW-OAHLLOKOSA-N
SMILES:
CCC[C@]12CC(=O)C(=C1CCCC2=C)C(=O)OC
Systematic name (3):
(3aR)-2-オキソ-3a-プロピル-4-メチレン-3,3a,4,5,6,7-ヘキサヒドロ-2H-インデン-1-カルボン酸メチル
メチル (7aR)-7-メチリデン-2-オキソ-7a-プロピル-2,4,5,6,7,7a-ヘキサヒドロ-1H-インデン-3-カルボキシラート
methyl (7aR)-7-methylidene-2-oxo-7a-propyl-2,4,5,6,7,7a-hexahydro-1H-indene-3-carboxylate
Other name (1):
(3aR)-2-Oxo-3a-propyl-4-methylene-3,3a,4,5,6,7-hexahydro-2H-indene-1-carboxylic acid methyl ester
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