Chem
J-GLOBAL ID：200907099498365350   Nikkaji number：J1.722.595B

PS-286A

(E)-2-メチル-4-[[(3aS)-1-メチル-1,2,3,3a,8,8aα-ヘキサヒドロピロロ[2,3-b]インドール]-3aα-イル]-2-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： C17H22N2O2
Molecular formula furigana： C17-H22-N2-O2
Molecular weight： 286.375
InChI： InChI=1S/C17H22N2O2/c1-12(15(20)21-3)8-9-17-10-11-19(2)16(17)18-14-7-5-4-6-13(14)17/h4-8,16,18H,9-11H2,1-3H3/b12-8+/t16-,17-/m0/s1
InChI key： IENBNBOKQXSCQE-MVIRQZGPSA-N
SMILES： COC(=O)/C(=C/C[C@@]12CCN(C)[C@@H]1Nc1ccccc21)/C
Systematic name  (3)：
  • (E)-2-メチル-4-[[(3aS)-1-メチル-1,2,3,3a,8,8aα-ヘキサヒドロピロロ[2,3-b]インドール]-3aα-イル]-2-ブテン酸メチル
  • メチル (2E)-4-[(3aS,8aS)-1-メチル-1H,2H,3H,3aH,8H,8aH-ピロロ[2,3-b]インドール-3a-イル]-2-メチルブタ-2-エノアート
  • methyl (2E)-4-[(3aS,8aS)-1-methyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-3a-yl]-2-methylbut-2-enoate
Other name (2)：
  • (E)-2-Methyl-4-[[(3aS)-1-methyl-1,2,3,3a,8,8aα-hexahydropyrrolo[2,3-b]indole]-3aα-yl]-2-butenoic acid methyl ester
  • PS-286A
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