Chem
J-GLOBAL ID:200907024482045886   Nikkaji number:J1.708.534D

(1β,5β)-2β-Propionyl-3β-(3-iodophenyl)-8-demethyltropane

(1β,5β)-2β-プロピオニル-3β-(3-ヨードフェニル)-8-デメチルトロパン
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: C16H20INO
Molecular formula furigana: C16-H20-I-N-O
Molecular weight: 369.246
InChI: InChI=1S/C16H20INO/c1-2-15(19)16-13(9-12-6-7-14(16)18-12)10-4-3-5-11(17)8-10/h3-5,8,12-14,16,18H,2,6-7,9H2,1H3/t12-,13+,14+,16-/m0/s1
InChI key: NPUPASYITYXDSJ-NHIYQJMISA-N
SMILES: CCC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1cccc(I)c1)N2
Systematic name  (3):
  • (1β,5β)-2β-プロピオニル-3β-(3-ヨードフェニル)-8-デメチルトロパン
  • 1-[(1R,2S,3S,5S)-3-(3-ヨードフェニル)-8-アザビシクロ[3.2.1]オクタン-2-イル]プロパン-1-オン
  • 1-[(1R,2S,3S,5S)-3-(3-iodophenyl)-8-azabicyclo[3.2.1]octan-2-yl]propan-1-one
Other name (1):
  • (1β,5β)-2β-Propionyl-3β-(3-iodophenyl)-8-demethyltropane
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