Chem
J-GLOBAL ID：200907040494128316   Nikkaji number：J5.845I

Amprotropine

アンプロトロピン
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： C18H29NO3
Molecular formula furigana： C18-H29-N-O3
Molecular weight： 307.434
InChI： InChI=1S/C18H29NO3/c1-5-19(6-2)13-18(3,4)14-22-17(21)16(12-20)15-10-8-7-9-11-15/h7-11,16,20H,5-6,12-14H2,1-4H3
InChI key： ORXLOAFNULMXBG-UHFFFAOYSA-N
SMILES： CCN(CC)CC(C)(C)COC(=O)C(CO)c1ccccc1
Systematic name  (3)：
  • α-(ヒドロキシメチル)ベンゼン酢酸3-(ジエチルアミノ)-2,2-ジメチルプロピル
  • 3-(ジエチルアミノ)-2,2-ジメチルプロピル 3-ヒドロキシ-2-フェニルプロパノアート
  • 3-(diethylamino)-2,2-dimethylpropyl 3-hydroxy-2-phenylpropanoate
Other name (4)：
  • アンプロトロピン
  • Amprotropine
  • α-(Hydroxymethyl)benzeneacetic acid 3-(diethylamino)-2,2-dimethylpropyl
  • α-(Hydroxymethyl)benzeneacetic acid 3-(diethylamino)-2,2-dimethylpropyl ester
CAS registry number： 148-32-3
KEGG COMPOUND： C11760
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