Chem
J-GLOBAL ID:200907050852509632   Nikkaji number:J2.300.963C

(1α,2β,5β,6α)-4-Phenyltricyclo[4.2.1.02,5]nonane-3-ene-3-carboxylic acid benzyl ester

(1α,2β,5β,6α)-4-フェニルトリシクロ[4.2.1.02,5]ノナン-3-エン-3-カルボン酸ベンジル
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: C23H22O2
Molecular formula furigana: C23-H22-O2
Molecular weight: 330.427
InChI: InChI=1S/C23H22O2/c24-23(25-14-15-7-3-1-4-8-15)22-19(16-9-5-2-6-10-16)20-17-11-12-18(13-17)21(20)22/h1-10,17-18,20-21H,11-14H2/t17-,18+,20-,21-/m0/s1
InChI key: UKOIXMGFYAZDGM-YHELAOLJSA-N
SMILES: O=C(OCc1ccccc1)C1=C([C@H]2[C@@H]1[C@@H]1CC[C@H]2C1)c1ccccc1
Systematic name  (3):
  • (1α,2β,5β,6α)-4-フェニルトリシクロ[4.2.1.02,5]ノナン-3-エン-3-カルボン酸ベンジル
  • ベンジル (1R,2S,5R,6S)-4-フェニルトリシクロ[4.2.1.02,5]ノナ-3-エン-3-カルボキシラート
  • benzyl (1R,2S,5R,6S)-4-phenyltricyclo[4.2.1.02,5]non-3-ene-3-carboxylate
Other name (1):
  • (1α,2β,5β,6α)-4-Phenyltricyclo[4.2.1.02,5]nonane-3-ene-3-carboxylic acid benzyl ester
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