Chem
J-GLOBAL ID:200907001027840562   Nikkaji number:J2.619.772D

2-[3-(Benzylamino)propyl]-5-cyclobutyl-2,3,4,5-tetrahydro-1H-2-benzoazepine-4α,5α-diol

2-[3-(ベンジルアミノ)プロピル]-5-シクロブチル-2,3,4,5-テトラヒドロ-1H-2-ベンゾアゼピン-4α,5α-ジオール
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: C24H32N2O2
Molecular formula furigana: C24-H32-N2-O2
Molecular weight: 380.532
InChI: InChI=1S/C24H32N2O2/c27-23-18-26(15-7-14-25-16-19-8-2-1-3-9-19)17-20-10-4-5-13-22(20)24(23,28)21-11-6-12-21/h1-5,8-10,13,21,23,25,27-28H,6-7,11-12,14-18H2/t23-,24+/m0/s1
InChI key: JSNCCKZUOJQJJZ-BJKOFHAPSA-N
SMILES: O[C@H]1CN(CCCNCc2ccccc2)Cc2ccccc2[C@]1(O)C1CCC1
Systematic name  (3):
  • 2-[3-(ベンジルアミノ)プロピル]-5-シクロブチル-2,3,4,5-テトラヒドロ-1H-2-ベンゾアゼピン-4α,5α-ジオール
  • (4S,5R)-2-[3-(ベンジルアミノ)プロピル]-5-シクロブチル-2,3,4,5-テトラヒドロ-1H-2-ベンゾアゼピン-4,5-ジオール
  • (4S,5R)-2-[3-(benzylamino)propyl]-5-cyclobutyl-2,3,4,5-tetrahydro-1H-2-benzazepine-4,5-diol
Other name (1):
  • 2-[3-(Benzylamino)propyl]-5-cyclobutyl-2,3,4,5-tetrahydro-1H-2-benzoazepine-4α,5α-diol
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