Chem
J-GLOBAL ID：200907013687373930   Nikkaji number：J2.452.053F

2-Ethoxy-6-benzyl-12-oxo-4,4aβ,5,6,11a,12,12bβ-heptahydro-3-oxa-6,7,11a-triazabenzo[a]anthracene-1-carbonitrile

(4aS,13aS)-12-ベンジル-3-エトキシ-5-オキソ-1,4a,5,12,13,13a-ヘキサヒドロ-2-オキサ-6,11,12-トリアザテトラフェン-4-カルボニトリル
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： C24H22N4O3
Molecular formula furigana： C24-H22-N4-O3
Molecular weight： 414.465
InChI： InChI=1S/C24H22N4O3/c1-2-30-24-18(12-25)20-17(15-31-24)14-27(13-16-8-4-3-5-9-16)22-21(20)23(29)28-11-7-6-10-19(28)26-22/h3-11,17,20H,2,13-15H2,1H3/t17-,20-/m0/s1
InChI key： YQHOTLJVRXFZPP-PXNSSMCTSA-N
SMILES： CCOC1=C(C#N)[C@@H]2[C@H](CO1)CN(Cc1ccccc1)c1nc3ccccn3c(=O)c21
Systematic name  (3)：
  • 2-エトキシ-6-ベンジル-12-オキソ-4,4aβ,5,6,11a,12,12bβ-ヘプタヒドロ-3-オキサ-6,7,11a-トリアザベンゾ[a]アントラセン-1-カルボニトリル
  • (4aS,13aS)-12-ベンジル-3-エトキシ-5-オキソ-1,4a,5,12,13,13a-ヘキサヒドロ-2-オキサ-6,11,12-トリアザテトラフェン-4-カルボニトリル
  • (4aS,13aS)-12-benzyl-3-ethoxy-5-oxo-1,4a,5,12,13,13a-hexahydro-2-oxa-6,11,12-triazatetraphene-4-carbonitrile
Other name (1)：
  • 2-Ethoxy-6-benzyl-12-oxo-4,4aβ,5,6,11a,12,12bβ-heptahydro-3-oxa-6,7,11a-triazabenzo[a]anthracene-1-carbonitrile
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM