Chem
J-GLOBAL ID：200907011124136255   Nikkaji number：J737.062H

2,2′-(2,2-Dimethyl-1,3-dioxolane-4β,5α-diyl)bis(4β-benzyl-2-oxazoline)

2,2′-(2,2-ジメチル-1,3-ジオキソラン-4β,5α-ジイル)ビス(4β-ベンジル-2-オキサゾリン)
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： C25H28N2O4
Molecular formula furigana： C25-H28-N2-O4
Molecular weight： 420.509
InChI： InChI=1S/C25H28N2O4/c1-25(2)30-21(23-26-19(15-28-23)13-17-9-5-3-6-10-17)22(31-25)24-27-20(16-29-24)14-18-11-7-4-8-12-18/h3-12,19-22H,13-16H2,1-2H3/t19-,20-,21+,22+/m0/s1
InChI key： VSFWOFQLEUKLFV-FNAHDJPLSA-N
SMILES： CC1(C)O[C@H]([C@@H](O1)C1=N[C@@H](Cc2ccccc2)CO1)C1=N[C@@H](Cc2ccccc2)CO1
Systematic name  (4)：
  • 2,2′-[(4R,5R)-2,2-ジメチル-1,3-ジオキソラン-4,5-ジイル]ビス[(S)-4-ベンジル-2-オキサゾリン]
  • 2,2′-(2,2-ジメチル-1,3-ジオキソラン-4β,5α-ジイル)ビス(4β-ベンジル-2-オキサゾリン)
  • (4S)-4-ベンジル-2-[(4R,5R)-5-[(4S)-4-ベンジル-4,5-ジヒドロ-1,3-オキサゾール-2-イル]-2,2-ジメチル-1,3-ジオキソラン-4-イル]-4,5-ジヒドロ-1,3-オキサゾール
  • (4S)-4-benzyl-2-[(4R,5R)-5-[(4S)-4-benzyl-4,5-dihydro-1,3-oxazol-2-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]-4,5-dihydro-1,3-oxazole
Other name (1)：
  • 2,2′-(2,2-Dimethyl-1,3-dioxolane-4β,5α-diyl)bis(4β-benzyl-2-oxazoline)
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