Chem
J-GLOBAL ID：200907017325052155   Nikkaji number：J2.452.047A

(4R)-4β-Phenyl-6-benzyl-1,2,4,4aβ,5,6,12,12bβ-octahydro-3-oxa-6,7,11a-triazabenzo[a]anthracene-2,12-dione

(4R)-4β-フェニル-6-ベンジル-1,2,4,4aβ,5,6,12,12bβ-オクタヒドロ-3-オキサ-6,7,11a-トリアザベンゾ[a]アントラセン-2,12-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： C27H23N3O3
Molecular formula furigana： C27-H23-N3-O3
Molecular weight： 437.499
InChI： InChI=1S/C27H23N3O3/c31-23-15-20-21(25(33-23)19-11-5-2-6-12-19)17-29(16-18-9-3-1-4-10-18)26-24(20)27(32)30-14-8-7-13-22(30)28-26/h1-14,20-21,25H,15-17H2/t20-,21-,25+/m1/s1
InChI key： OACXZJVHFBTVMH-OTPAQWSUSA-N
SMILES： O=C1C[C@@H]2[C@@H](CN(Cc3ccccc3)c3nc4ccccn4c(=O)c23)[C@@H](O1)c1ccccc1
Systematic name  (3)：
  • (4R)-4β-フェニル-6-ベンジル-1,2,4,4aβ,5,6,12,12bβ-オクタヒドロ-3-オキサ-6,7,11a-トリアザベンゾ[a]アントラセン-2,12-ジオン
  • (1R,4aR,13aS)-12-ベンジル-1-フェニル-1,3,4,4a,5,12,13,13a-オクタヒドロ-2-オキサ-6,11,12-トリアザテトラフェン-3,5-ジオン
  • (1R,4aR,13aS)-12-benzyl-1-phenyl-1,3,4,4a,5,12,13,13a-octahydro-2-oxa-6,11,12-triazatetraphene-3,5-dione
Other name (1)：
  • (4R)-4β-Phenyl-6-benzyl-1,2,4,4aβ,5,6,12,12bβ-octahydro-3-oxa-6,7,11a-triazabenzo[a]anthracene-2,12-dione
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