Chem
J-GLOBAL ID:200907051613660295   Nikkaji number:J995.959I

[2,3-Diphenyl-3aβ,4,5,7a-tetrahydro-7aβ-(methoxycarbonyl)-1H-indene-5β-yl]malonic acid diethyl ester

[2,3-ジフェニル-3aβ,4,5,7a-テトラヒドロ-7aβ-(メトキシカルボニル)-1H-インデン-5β-イル]マロン酸ジエチル
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: C30H32O6
Molecular formula furigana: C30-H32-O6
Molecular weight: 488.580
InChI: InChI=1S/C30H32O6/c1-4-35-27(31)26(28(32)36-5-2)22-16-17-30(29(33)34-3)19-23(20-12-8-6-9-13-20)25(24(30)18-22)21-14-10-7-11-15-21/h6-17,22,24,26H,4-5,18-19H2,1-3H3/t22-,24-,30-/m0/s1
InChI key: AILUJFKTXAJJEE-RSDZZNSJSA-N
SMILES: CCOC(=O)C([C@@H]1C[C@H]2C(=C(C[C@]2(C=C1)C(=O)OC)c1ccccc1)c1ccccc1)C(=O)OCC
Systematic name  (4):
  • [2,3-ジフェニル-3aβ,4,5,7a-テトラヒドロ-7aβ-(メトキシカルボニル)-1H-インデン-5β-イル]マロン酸ジエチル
  • (3aS)-2,3-ジフェニル-5β-[1-(エトキシカルボニル)-2-オキソ-2-エトキシエチル]-4,5-ジヒドロ-1H-インデン-7aβ(3aβH)-カルボン酸メチル
  • 1,3-ジエチル 2-[(3aS,5R,7aR)-7a-(メトキシカルボニル)-2,3-ジフェニル-3a,4,5,7a-テトラヒドロ-1H-インデン-5-イル]プロパンジオアート
  • 1,3-diethyl 2-[(3aS,5R,7aR)-7a-(methoxycarbonyl)-2,3-diphenyl-3a,4,5,7a-tetrahydro-1H-inden-5-yl]propanedioate
Other name (2):
  • [2,3-Diphenyl-3aβ,4,5,7a-tetrahydro-7aβ-(methoxycarbonyl)-1H-indene-5β-yl]malonic acid diethyl ester
  • (3aS)-2,3-Diphenyl-5β-[1-(ethoxycarbonyl)-2-oxo-2-ethoxyethyl]-4,5-dihydro-1H-indene-7aβ(3aβH)-carboxylic acid methyl ester
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