Chem
J-GLOBAL ID：200907072708437353   Nikkaji number：J1.802.302D

(S)-2-[(3S)-1-Tosyl-4β-(3-methyl-1-butenyl)pyrrolidine-3α-yl]-3-butenoic acid methyl ester

(S)-2-[(3S)-1-トシル-4β-(3-メチル-1-ブテニル)ピロリジン-3α-イル]-3-ブテン酸メチル
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： C21H29NO4S
Molecular formula furigana： C21-H29-N-O4-S
Molecular weight： 391.530
InChI： InChI=1S/C21H29NO4S/c1-6-19(21(23)26-5)20-14-22(13-17(20)10-7-15(2)3)27(24,25)18-11-8-16(4)9-12-18/h6-12,15,17,19-20H,1,13-14H2,2-5H3/t17-,19-,20-/m0/s1
InChI key： RRPYTDMYDARCSE-IHPCNDPISA-N
SMILES： COC(=O)[C@@H](C=C)[C@H]1CN(C[C@@H]1C=CC(C)C)S(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • (S)-2-[(3S)-1-トシル-4β-(3-メチル-1-ブテニル)ピロリジン-3α-イル]-3-ブテン酸メチル
  • メチル (2S)-2-[(3S,4R)-1-(4-メチルベンゼンスルホニル)-4-(3-メチルブタ-1-エン-1-イル)ピロリジン-3-イル]ブタ-3-エノアート
  • methyl (2S)-2-[(3S,4R)-1-(4-methylbenzenesulfonyl)-4-(3-methylbut-1-en-1-yl)pyrrolidin-3-yl]but-3-enoate
Other name (1)：
  • (S)-2-[(3S)-1-Tosyl-4β-(3-methyl-1-butenyl)pyrrolidine-3α-yl]-3-butenoic acid methyl ester
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