Chem
J-GLOBAL ID:201707020847287768   Nikkaji number:J3.600.228J

1′-Benzyl-3-phenyl-3β-hydroxy-7-(dibenzylamino)spiro[2H-1-benzopyran-4(3H),3′(2′H)-[1H]indole]-2′-one

1′-ベンジル-3-フェニル-3β-ヒドロキシ-7-(ジベンジルアミノ)スピロ[2H-1-ベンゾピラン-4(3H),3′(2′H)-[1H]インドール]-2′-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: C43H36N2O3
Molecular formula furigana: C43-H36-N2-O3
Molecular weight: 628.772
InChI: InChI=1S/C43H36N2O3/c46-41-43(37-23-13-14-24-39(37)45(41)30-34-19-9-3-10-20-34)38-26-25-36(27-40(38)48-31-42(43,47)35-21-11-4-12-22-35)44(28-32-15-5-1-6-16-32)29-33-17-7-2-8-18-33/h1-27,47H,28-31H2/t42-,43?/m0/s1
InChI key: WAIGWBCQXQONSD-ZAGGQVEOSA-N
SMILES: O[C@@]1(COc2cc(ccc2C21C(=O)N(Cc1ccccc1)c1ccccc21)N(Cc1ccccc1)Cc1ccccc1)c1ccccc1
Systematic name  (3):
  • 1′-ベンジル-3-フェニル-3β-ヒドロキシ-7-(ジベンジルアミノ)スピロ[2H-1-ベンゾピラン-4(3H),3′(2′H)-[1H]インドール]-2′-オン
  • (3S)-1'-ベンジル-7-(ジベンジルアミノ)-3-ヒドロキシ-3-フェニル-1',2,2',3-テトラヒドロスピロ[1-ベンゾピラン-4,3'-インドール]-2'-オン
  • (3S)-1'-benzyl-7-(dibenzylamino)-3-hydroxy-3-phenyl-1',2,2',3-tetrahydrospiro[1-benzopyran-4,3'-indol]-2'-one
Other name (1):
  • 1′-Benzyl-3-phenyl-3β-hydroxy-7-(dibenzylamino)spiro[2H-1-benzopyran-4(3H),3′(2′H)-[1H]indole]-2′-one
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