Chem
J-GLOBAL ID：200907002813507890
Nikkaji number：J1.921.665I
Benzoic acid [(1R,2S,3S,6R,7S)-4-benzoyl-4-azatricyclo[5.2.1.02,6]deca-8-ene-3-yl]methyl ester
安息香酸[(1R,2S,3S,6R,7S)-4-ベンゾイル-4-アザトリシクロ[5.2.1.02,6]デカ-8-エン-3-イル]メチル
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
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
Molecular formula： C24H23NO3
Molecular formula furigana： C24-H23-N-O3
Molecular weight： 373.452
InChI：
InChI=1S/C24H23NO3/c26-23(16-7-3-1-4-8-16)25-14-20-18-11-12-19(13-18)22(20)21(25)15-28-24(27)17-9-5-2-6-10-17/h1-12,18-22H,13-15H2/t18-,19+,20-,21-,22+/m1/s1
InChI key：
ZSXYBJUFLKHIDJ-YHINDDMVSA-N
SMILES：
O=C(OC[C@@H]1[C@H]2[C@@H]3C[C@@H](C=C3)[C@H]2CN1C(=O)c1ccccc1)c1ccccc1
Systematic name (3)：
- 安息香酸[(1R,2S,3S,6R,7S)-4-ベンゾイル-4-アザトリシクロ[5.2.1.02,6]デカ-8-エン-3-イル]メチル
- [(1R,2S,3S,6R,7S)-4-ベンゾイル-4-アザトリシクロ[5.2.1.02,6]デカ-8-エン-3-イル]メチル ベンゾアート
- [(1R,2S,3S,6R,7S)-4-benzoyl-4-azatricyclo[5.2.1.02,6]dec-8-en-3-yl]methyl benzoate
- Benzoic acid [(1R,2S,3S,6R,7S)-4-benzoyl-4-azatricyclo[5.2.1.02,6]deca-8-ene-3-yl]methyl ester
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