Chem
J-GLOBAL ID：200907074539950251   Nikkaji number：J1.306.661B

TAN-1251B

(1′R,3R,5′R)-3-ヒドロキシ-2′-[(Z)-4-(3-メチル-2-ブテニルオキシ)ベンジリデン]-4′-メチルスピロ[シクロヘキサン-1,7′-[1,4]ジアザビシクロ[3.2.1]オクタン]-4-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： C24H32N2O3
Molecular formula furigana： C24-H32-N2-O3
Molecular weight： 396.531
InChI： InChI=1S/C24H32N2O3/c1-17(2)9-11-29-21-6-4-18(5-7-21)12-19-15-25(3)20-13-24(26(19)16-20)10-8-22(27)23(28)14-24/h4-7,9,12,20,23,28H,8,10-11,13-16H2,1-3H3/b19-12-/t20-,23-,24?/m1/s1
InChI key： FPPRJYAJMDHXPM-MCSVFMTLSA-N
SMILES： CN1C/C(=C/c2ccc(OCC=C(C)C)cc2)/N2C[C@H]1CC12CCC(=O)[C@H](O)C1
Systematic name  (3)：
  • (1′R,3R,5′R)-3-ヒドロキシ-2′-[(Z)-4-(3-メチル-2-ブテニルオキシ)ベンジリデン]-4′-メチルスピロ[シクロヘキサン-1,7′-[1,4]ジアザビシクロ[3.2.1]オクタン]-4-オン
  • (1R,3'R,4Z)-3'-ヒドロキシ-2-メチル-4-({4-[(3-メチルブタ-2-エン-1-イル)オキシ]フェニル}メチリデン)-2,5-ジアザスピロ[ビシクロ[3.2.1]オクタン-6,1'-シクロヘキサン]-4'-オン
  • (1R,3'R,4Z)-3'-hydroxy-2-methyl-4-({4-[(3-methylbut-2-en-1-yl)oxy]phenyl}methylidene)-2,5-diazaspiro[bicyclo[3.2.1]octane-6,1'-cyclohexan]-4'-one
Other name (2)：
  • (1′R,3R,5′R)-3-Hydroxy-2′-[(Z)-4-(3-methyl-2-butenyloxy)benzylidene]-4′-methylspiro[cyclohexane-1,7′-[1,4]diazabicyclo[3.2.1]octane]-4-one
  • TAN-1251B
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