Chem
J-GLOBAL ID:200907018050582660   Nikkaji number:J2.685.547K

(4R)-1-(2-Methylpropylidene)-3-methyl-4β-(hydroxymethyl)-8-methoxy-1,2,4,5-tetrahydro-3H-3-benzoazepine-2-one

(4R)-4-(ヒドロキシメチル)-8-メトキシ-3-メチル-1-(2-メチルプロピリデン)-2,3,4,5-テトラヒドロ-1H-3-ベンゾアゼピン-2-オン
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: C17H23NO3
Molecular formula furigana: C17-H23-N-O3
Molecular weight: 289.375
InChI: InChI=1S/C17H23NO3/c1-11(2)7-16-15-9-14(21-4)6-5-12(15)8-13(10-19)18(3)17(16)20/h5-7,9,11,13,19H,8,10H2,1-4H3/t13-/m1/s1
InChI key: HIKWHLCUGQTKLI-CYBMUJFWSA-N
SMILES: COc1ccc2C[C@H](CO)N(C)C(=O)C(=CC(C)C)c2c1
Systematic name  (3):
  • (4R)-1-(2-メチルプロピリデン)-3-メチル-4β-(ヒドロキシメチル)-8-メトキシ-1,2,4,5-テトラヒドロ-3H-3-ベンゾアゼピン-2-オン
  • (4R)-4-(ヒドロキシメチル)-8-メトキシ-3-メチル-1-(2-メチルプロピリデン)-2,3,4,5-テトラヒドロ-1H-3-ベンゾアゼピン-2-オン
  • (4R)-4-(hydroxymethyl)-8-methoxy-3-methyl-1-(2-methylpropylidene)-2,3,4,5-tetrahydro-1H-3-benzazepin-2-one
Other name (1):
  • (4R)-1-(2-Methylpropylidene)-3-methyl-4β-(hydroxymethyl)-8-methoxy-1,2,4,5-tetrahydro-3H-3-benzoazepine-2-one
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