Chem
J-GLOBAL ID:200907050802361456   Nikkaji number:J1.554.214D

2α-(4-Chlorophenyl)-10,11-dimethoxy-7,8-dihydrospiro[azepino[2,1-a]isoquinoline-3(2H),9′-[9H]fluorene]-4,5-dicarboxylic acid dimethyl ester

2α-(4-クロロフェニル)-10,11-ジメトキシ-7,8-ジヒドロスピロ[アゼピノ[2,1-a]イソキノリン-3(2H),9′-[9H]フルオレン]-4,5-ジカルボン酸ジメチル
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: C38H32ClNO6
Molecular formula furigana: C38-H32-CL-N-O6
Molecular weight: 634.130
InChI: InChI=1S/C38H32ClNO6/c1-43-32-19-23-17-18-40-31(27(23)20-33(32)44-2)21-30(22-13-15-24(39)16-14-22)38(34(36(41)45-3)35(40)37(42)46-4)28-11-7-5-9-25(28)26-10-6-8-12-29(26)38/h5-16,19-21,30H,17-18H2,1-4H3/t30-/m1/s1
InChI key: AYPABLWHIMKJCT-SSEXGKCCSA-N
SMILES: COC(=O)C1=C(C(=O)OC)C2([C@H](C=C3N1CCc1cc(OC)c(OC)cc31)c1ccc(Cl)cc1)c1ccccc1c1ccccc21
Systematic name  (3):
  • 2α-(4-クロロフェニル)-10,11-ジメトキシ-7,8-ジヒドロスピロ[アゼピノ[2,1-a]イソキノリン-3(2H),9′-[9H]フルオレン]-4,5-ジカルボン酸ジメチル
  • 4,5-ジメチル (2R)-2-(4-クロロフェニル)-10,11-ジメトキシ-7,8-ジヒドロ-2H-スピロ[アゼピノ[2,1-a]イソキノリン-3,9'-フルオレン]-4,5-ジカルボキシラート
  • 4,5-dimethyl (2R)-2-(4-chlorophenyl)-10,11-dimethoxy-7,8-dihydro-2H-spiro[azepino[2,1-a]isoquinoline-3,9'-fluorene]-4,5-dicarboxylate
Other name (1):
  • 2α-(4-Chlorophenyl)-10,11-dimethoxy-7,8-dihydrospiro[azepino[2,1-a]isoquinoline-3(2H),9′-[9H]fluorene]-4,5-dicarboxylic acid dimethyl ester
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