Chem
J-GLOBAL ID：201707007969816293   Nikkaji number：J3.601.592F

2-Ethyl-6-[3-(2-oxo-2H-1-benzopyran-3-yl)-5-(4-bromophenyl)-2-pyrazoline-1-yl]-1H-benzo[de]isoquinoline-1,3(2H)-dione

2-エチル-6-[3-(2-オキソ-2H-1-ベンゾピラン-3-イル)-5-(4-ブロモフェニル)-2-ピラゾリン-1-イル]-1H-ベンゾ[de]イソキノリン-1,3(2H)-ジオン
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： C32H22BrN3O4
Molecular formula furigana： C32-H22-BR-N3-O4
Molecular weight： 592.449
InChI： InChI=1S/C32H22BrN3O4/c1-2-35-30(37)22-8-5-7-21-26(15-14-23(29(21)22)31(35)38)36-27(18-10-12-20(33)13-11-18)17-25(34-36)24-16-19-6-3-4-9-28(19)40-32(24)39/h3-16,27H,2,17H2,1H3
InChI key： HTSRUGJLUAXNSM-UHFFFAOYSA-N
SMILES： CCn1c(=O)c2cccc3c(ccc(c1=O)c23)N1N=C(CC1c1ccc(Br)cc1)c1cc2ccccc2oc1=O
Systematic name  (3)：
  • 2-エチル-6-[3-(2-オキソ-2H-1-ベンゾピラン-3-イル)-5-(4-ブロモフェニル)-2-ピラゾリン-1-イル]-1H-ベンゾ[de]イソキノリン-1,3(2H)-ジオン
  • 8-[5-(4-ブロモフェニル)-3-(2-オキソ-2H-クロメン-3-イル)-4,5-ジヒドロ-1H-ピラゾール-1-イル]-3-エチル-3-アザトリシクロ[7.3.1.05,13]トリデカ-1(13),5,7,9,11-ペンタエン-2,4-ジオン
  • 8-[5-(4-bromophenyl)-3-(2-oxo-2H-chromen-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-3-ethyl-3-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-2,4-dione
Other name (1)：
  • 2-Ethyl-6-[3-(2-oxo-2H-1-benzopyran-3-yl)-5-(4-bromophenyl)-2-pyrazoline-1-yl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
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