Chem
J-GLOBAL ID：200907073235452089   Nikkaji number：J1.459.220B

(8aS)-2-(4-Methoxyphenyl)-2,3,8,8aα-tetrahydro-1H-2,3a-diaza-3-boracyclopenta[a]indene

(3aS)-2-(4-メトキシフェニル)-1H,2H,3H,3aH,4H-[1,3,2]ジアザボロロ[1,5-a]インドール
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： C16H17BN2O
Molecular formula furigana： C16-H17-B-N2-O
Molecular weight： 264.140
InChI： InChI=1S/C16H17BN2O/c1-20-15-8-6-13(7-9-15)18-11-14-10-12-4-2-3-5-16(12)19(14)17-18/h2-9,14,17H,10-11H2,1H3/t14-/m0/s1
InChI key： NQAJKCYRTJPLLS-AWEZNQCLSA-N
SMILES： COc1ccc(cc1)N1BN2[C@H](C1)Cc1ccccc21
Systematic name  (3)：
  • (8aS)-2-(4-メトキシフェニル)-2,3,8,8aα-テトラヒドロ-1H-2,3a-ジアザ-3-ボラシクロペンタ[a]インデン
  • (3aS)-2-(4-メトキシフェニル)-1H,2H,3H,3aH,4H-[1,3,2]ジアザボロロ[1,5-a]インドール
  • (3aS)-2-(4-methoxyphenyl)-1H,2H,3H,3aH,4H-[1,3,2]diazaborolo[1,5-a]indole
Other name (1)：
  • (8aS)-2-(4-Methoxyphenyl)-2,3,8,8aα-tetrahydro-1H-2,3a-diaza-3-boracyclopenta[a]indene
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