Chem
J-GLOBAL ID：200907056950228895   Nikkaji number：J915.275J

Ro-25-6981

Ro-25-6981
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： C22H29NO2
Molecular formula furigana： C22-H29-N-O2
Molecular weight： 339.479
InChI： InChI=1S/C22H29NO2/c1-17(22(25)20-7-9-21(24)10-8-20)16-23-13-11-19(12-14-23)15-18-5-3-2-4-6-18/h2-10,17,19,22,24-25H,11-16H2,1H3/t17-,22+/m0/s1
InChI key： WVZSEUPGUDIELE-HTAPYJJXSA-N
SMILES： C[C@@H](CN1CCC(Cc2ccccc2)CC1)[C@@H](O)c1ccc(O)cc1
Systematic name  (4)：
  • (1R,2S)-3-(4-ベンジル-1-ピペリジニル)-2-メチル-1-(4-ヒドロキシフェニル)-1-プロパノール
  • (1R,2S)-1-(4-ヒドロキシフェニル)-2-メチル-3-(4-ベンジルピペリジノ)-1-プロパノール
  • 4-[(1R,2S)-3-(4-ベンジルピペリジン-1-イル)-1-ヒドロキシ-2-メチルプロピル]フェノール
  • 4-[(1R,2S)-3-(4-benzylpiperidin-1-yl)-1-hydroxy-2-methylpropyl]phenol
Other name (4)：
  • Ro-25-6981
  • (1R,2S)-1-(4-Hydroxyphenyl)-2-methyl-3-(4-benzylpiperidino)-1-propanol
  • (1R,2S)-3-(4-Benzyl-1-piperidinyl)-2-methyl-1-(4-hydroxyphenyl)-1-propanol
  • Ro25-6981
CAS registry number： 169274-78-6
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