Chem
J-GLOBAL ID:200907027112385539   Nikkaji number:J1.963.107I

1-Ethyl-4-(4-bromoanilino)-1H-5-selena-1,3,6-triazaaceanthrylene-2-carboxylic acid methyl ester

1-エチル-4-(4-ブロモアニリノ)-1H-5-セレナ-1,3,6-トリアザアセアントリレン-2-カルボン酸メチル
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: C22H17BrN4O2Se
Molecular formula furigana: C22-H17-BR-N4-O2-SE
Molecular weight: 528.279
InChI: InChI=1S/C22H17BrN4O2Se/c1-3-27-18-14-6-4-5-7-15(14)25-20-16(18)17(19(27)21(28)29-2)26-22(30-20)24-13-10-8-12(23)9-11-13/h4-11H,3H2,1-2H3,(H,24,26)
InChI key: KVWVYCLXVPFFTK-UHFFFAOYSA-N
SMILES: CCn1c(C(=O)OC)c2nc(Nc3ccc(Br)cc3)[se]c3nc4ccccc4c1c23
Systematic name  (3):
  • 1-エチル-4-(4-ブロモアニリノ)-1H-5-セレナ-1,3,6-トリアザアセアントリレン-2-カルボン酸メチル
  • メチル 11-[(4-ブロモフェニル)アミノ]-15-エチル-10-セレナ-8,12,15-トリアザテトラシクロ[7.6.1.02,7.013,16]ヘキサデカ-1(16),2,4,6,8,11,13-ヘプタエン-14-カルボキシラート
  • methyl 11-[(4-bromophenyl)amino]-15-ethyl-10-selena-8,12,15-triazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,8,11,13-heptaene-14-carboxylate
Other name (1):
  • 1-Ethyl-4-(4-bromoanilino)-1H-5-selena-1,3,6-triazaaceanthrylene-2-carboxylic acid methyl ester
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