Chem
J-GLOBAL ID:201307082788764773   Nikkaji number:J3.151.041D

2-[(1R,2R)-1,2-Diphenyl-2-(2-hydroxy-3,5-diiodobenzylamino)ethyl]-1,3-dihydro-2H-isoindole

2-[(1R,2R)-1,2-ジフェニル-2-(2-ヒドロキシ-3,5-ジヨードベンジルアミノ)エチル]-1,3-ジヒドロ-2H-イソインドール
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: C29H26I2N2O
Molecular formula furigana: C29-H26-I2-N2-O
Molecular weight: 672.349
InChI: InChI=1S/C29H26I2N2O/c30-25-15-24(29(34)26(31)16-25)17-32-27(20-9-3-1-4-10-20)28(21-11-5-2-6-12-21)33-18-22-13-7-8-14-23(22)19-33/h1-16,27-28,32,34H,17-19H2/t27-,28-/m1/s1
InChI key: XMTDYJSPNDIBJU-VSGBNLITSA-N
SMILES: Oc1c(I)cc(I)cc1CN[C@@H]([C@H](N1Cc2ccccc2C1)c1ccccc1)c1ccccc1
Systematic name  (3):
  • 2-[(1R,2R)-1,2-ジフェニル-2-(2-ヒドロキシ-3,5-ジヨードベンジルアミノ)エチル]-1,3-ジヒドロ-2H-イソインドール
  • 2-({[(1R,2R)-2-(2,3-ジヒドロ-1H-イソインドール-2-イル)-1,2-ジフェニルエチル]アミノ}メチル)-4,6-ジヨードフェノール
  • 2-({[(1R,2R)-2-(2,3-dihydro-1H-isoindol-2-yl)-1,2-diphenylethyl]amino}methyl)-4,6-diiodophenol
Other name (1):
  • 2-[(1R,2R)-1,2-Diphenyl-2-(2-hydroxy-3,5-diiodobenzylamino)ethyl]-1,3-dihydro-2H-isoindole
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