Chem
J-GLOBAL ID:200907024794848218   Nikkaji number:J1.080.826J

1-Isopropyl-6,8-dimethyl-8,9-didehydroergoline

1-イソプロピル-6,8-ジメチル-8,9-ジデヒドロエルゴリン
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: C19H24N2
Molecular formula furigana: C19-H24-N2
Molecular weight: 280.415
InChI: InChI=1S/C19H24N2/c1-12(2)21-11-14-9-18-16(8-13(3)10-20(18)4)15-6-5-7-17(21)19(14)15/h5-8,11-12,16,18H,9-10H2,1-4H3/t16-,18-/m1/s1
InChI key: WOCFAMZJXVPMCN-SJLPKXTDSA-N
SMILES: CC(C)n1cc2C[C@@H]3[C@H](C=C(C)CN3C)c3cccc1c23
Systematic name  (4):
  • (6aR)-4-イソプロピル-7,9-ジメチル-4,6,6aα,7,8,10aβ-ヘキサヒドロインドロ[4,3-fg]キノリン
  • 1-イソプロピル-6,8-ジメチル-8,9-ジデヒドロエルゴリン
  • (2R,7R)-4,6-ジメチル-11-(プロパン-2-イル)-6,11-ジアザテトラシクロ[7.6.1.02,7.012,16]ヘキサデカ-1(16),3,9,12,14-ペンタエン
  • (2R,7R)-4,6-dimethyl-11-(propan-2-yl)-6,11-diazatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),3,9,12,14-pentaene
Other name (2):
  • (6aR)-4-Isopropyl-7,9-dimethyl-4,6,6aα,7,8,10aβ-hexahydroindolo[4,3-fg]quinoline
  • 1-Isopropyl-6,8-dimethyl-8,9-didehydroergoline
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