Chem
J-GLOBAL ID：200907030767657427   Nikkaji number：J1.939.287B

(1R,3aS)-1-(2-Methoxyphenyl)-2-(4-bromophenyl)-1,2,3,3a,4,5,6-heptahydro-2,6a-diaza-1-phosphapentalene

(3aS)-2-(4-ブロモフェニル)-1-(2-メトキシフェニル)-ヘキサヒドロ-1H-ピロロ[1,2-c][1,3,2]ジアザホスホール
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： C18H20BrN2OP
Molecular formula furigana： C18-H20-BR-N2-O-P
Molecular weight： 391.249
InChI： InChI=1S/C18H20BrN2OP/c1-22-17-6-2-3-7-18(17)23-20-12-4-5-16(20)13-21(23)15-10-8-14(19)9-11-15/h2-3,6-11,16H,4-5,12-13H2,1H3/t16-,23?/m0/s1
InChI key： UTVZPJJFKNJJPL-GZWBLTSWSA-N
SMILES： COc1ccccc1P1N2CCC[C@H]2CN1c1ccc(Br)cc1
Systematic name  (3)：
  • (1R,3aS)-1-(2-メトキシフェニル)-2-(4-ブロモフェニル)-1,2,3,3a,4,5,6-ヘプタヒドロ-2,6a-ジアザ-1-ホスファペンタレン
  • (3aS)-2-(4-ブロモフェニル)-1-(2-メトキシフェニル)-ヘキサヒドロ-1H-ピロロ[1,2-c][1,3,2]ジアザホスホール
  • (3aS)-2-(4-bromophenyl)-1-(2-methoxyphenyl)-hexahydro-1H-pyrrolo[1,2-c][1,3,2]diazaphosphole
Other name (1)：
  • (1R,3aS)-1-(2-Methoxyphenyl)-2-(4-bromophenyl)-1,2,3,3a,4,5,6-heptahydro-2,6a-diaza-1-phosphapentalene
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