Chem
J-GLOBAL ID：200907081827652504   Nikkaji number：J9.669E

Alphacetylmethadol

アルファセチルメタドール
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： C23H31NO2
Molecular formula furigana： C23-H31-N-O2
Molecular weight： 353.506
InChI： InChI=1S/C23H31NO2/c1-6-22(26-19(3)25)23(17-18(2)24(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18,22H,6,17H2,1-5H3/t18-,22-/m1/s1
InChI key： XBMIVRRWGCYBTQ-XMSQKQJNSA-N
SMILES： CC[C@@H](OC(=O)C)C(C[C@@H](C)N(C)C)(c1ccccc1)c1ccccc1
Systematic name  (3)：
  • 酢酸[1R,4R,(+)]-1-エチル-4-(ジメチルアミノ)-2,2-ジフェニルペンチル
  • (3R,6R)-6-(ジメチルアミノ)-4,4-ジフェニルヘプタン-3-イル アセタート
  • (3R,6R)-6-(dimethylamino)-4,4-diphenylheptan-3-yl acetate
Other name (3)：
  • アルファセチルメタドール
  • Alphacetylmethadol
  • Acetic acid [1R,4R,(+)]-1-ethyl-4-(dimethylamino)-2,2-diphenylpentyl ester
CAS registry number： 17199-58-5
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