Chem
J-GLOBAL ID:200907028348972784   Nikkaji number:J1.912.943H

1-Benzyl-2-oxo-3-(2-bromo-3-methyl-4-methoxy-5-isopropoxybenzyl)-5,6-(methylenedioxy)-7-methyl-8-(tosyloxy)-2,3,4,9-tetrahydro-1H-indeno[1,2-b]pyrazine-4-carboxylic acid isopropyl ester

1-ベンジル-2-オキソ-3-(2-ブロモ-3-メチル-4-メトキシ-5-イソプロポキシベンジル)-5,6-(メチレンジオキシ)-7-メチル-8-(トシルオキシ)-2,3,4,9-テトラヒドロ-1H-インデノ[1,2-b]ピラジン-4-カルボン酸イソプロピル
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: C43H45BrN2O10S
Molecular formula furigana: C43-H45-BR-N2-O10-S
Molecular weight: 861.800
InChI: InChI=1S/C43H45BrN2O10S/c1-23(2)54-34-19-29(36(44)26(6)39(34)51-8)18-33-42(47)45(21-28-12-10-9-11-13-28)32-20-31-35(37(32)46(33)43(48)55-24(3)4)41-40(52-22-53-41)27(7)38(31)56-57(49,50)30-16-14-25(5)15-17-30/h9-17,19,23-24,33H,18,20-22H2,1-8H3
InChI key: LSBSOJPDAGQNOI-UHFFFAOYSA-N
SMILES: COc1c(C)c(Br)c(CC2N(C(=O)OC(C)C)C3=C(Cc4c3c3OCOc3c(C)c4OS(=O)(=O)c3ccc(C)cc3)N(Cc3ccccc3)C2=O)cc1OC(C)C
Systematic name  (3):
  • 1-ベンジル-2-オキソ-3-(2-ブロモ-3-メチル-4-メトキシ-5-イソプロポキシベンジル)-5,6-(メチレンジオキシ)-7-メチル-8-(トシルオキシ)-2,3,4,9-テトラヒドロ-1H-インデノ[1,2-b]ピラジン-4-カルボン酸イソプロピル
  • プロパン-2-イル 12-ベンジル-14-{[2-ブロモ-4-メトキシ-3-メチル-5-(プロパン-2-イルオキシ)フェニル]メチル}-7-メチル-8-[(4-メチルベンゼンスルホニル)オキシ]-13-オキソ-3,5-ジオキサ-12,15-ジアザテトラシクロ[7.7.0.02,6.011,16]ヘキサデカ-1(9),2(6),7,11(16)-テトラエン-15-カルボキシラート
  • propan-2-yl 12-benzyl-14-{[2-bromo-4-methoxy-3-methyl-5-(propan-2-yloxy)phenyl]methyl}-7-methyl-8-[(4-methylbenzenesulfonyl)oxy]-13-oxo-3,5-dioxa-12,15-diazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16)-tetraene-15-carboxylate
Other name (1):
  • 1-Benzyl-2-oxo-3-(2-bromo-3-methyl-4-methoxy-5-isopropoxybenzyl)-5,6-(methylenedioxy)-7-methyl-8-(tosyloxy)-2,3,4,9-tetrahydro-1H-indeno[1,2-b]pyrazine-4-carboxylic acid isopropyl ester
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