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Chem
J-GLOBAL ID：200907092650164247
Nikkaji number：J1.266.459A 8-[3-(2-Pyridylamino)propoxy]-2-(2,2,2-trifluoroethyl)-3-oxo-2,3,4,5-tetrahydro-1H-2-benzazepine-4-acetic acid
8-[3-(2-ピリジルアミノ)プロポキシ]-2-(2,2,2-トリフルオロエチル)-3-オキソ-2,3,4,5-テトラヒドロ-1H-2-ベンゾアゼピン-4-酢酸
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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： C22H24F3N3O4
Molecular formula furigana： C22-H24-F3-N3-O4
Molecular weight： 451.446
InChI：
InChI=1S/C22H24F3N3O4/c23-22(24,25)14-28-13-17-11-18(32-9-3-8-27-19-4-1-2-7-26-19)6-5-15(17)10-16(21(28)31)12-20(29)30/h1-2,4-7,11,16H,3,8-10,12-14H2,(H,26,27)(H,29,30)
InChI key：
PVDGZHKJXXVONO-UHFFFAOYSA-N
SMILES：
OC(=O)CC1Cc2ccc(OCCCNc3ccccn3)cc2CN(CC(F)(F)F)C1=O
Systematic name (3)： - 8-[3-(2-ピリジルアミノ)プロポキシ]-2-(2,2,2-トリフルオロエチル)-3-オキソ-2,3,4,5-テトラヒドロ-1H-2-ベンゾアゼピン-4-酢酸
- 2-(3-オキソ-8-{3-[(ピリジン-2-イル)アミノ]プロポキシ}-2-(2,2,2-トリフルオロエチル)-2,3,4,5-テトラヒドロ-1H-2-ベンゾアゼピン-4-イル)酢酸
- 2-(3-oxo-8-{3-[(pyridin-2-yl)amino]propoxy}-2-(2,2,2-trifluoroethyl)-2,3,4,5-tetrahydro-1H-2-benzazepin-4-yl)acetic acid
- 8-[3-(2-Pyridylamino)propoxy]-2-(2,2,2-trifluoroethyl)-3-oxo-2,3,4,5-tetrahydro-1H-2-benzazepine-4-acetic acid
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