Chem
J-GLOBAL ID:201207016400432588   Nikkaji number:J3.068.702G

1-Methyl-2-oxo-6-[(methoxycarbonyl)amino]-8-phenyl-2,3,5,6-tetrahydro-1,4-diazocine-4(1H)-carboxylic acid tert-butyl ester

1-メチル-2-オキソ-6-[(メトキシカルボニル)アミノ]-8-フェニル-2,3,5,6-テトラヒドロ-1,4-ジアゾシン-4(1H)-カルボン酸tert-ブチル
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: C20H27N3O5
Molecular formula furigana: C20-H27-N3-O5
Molecular weight: 389.452
InChI: InChI=1S/C20H27N3O5/c1-20(2,3)28-19(26)23-12-15(21-18(25)27-5)11-16(22(4)17(24)13-23)14-9-7-6-8-10-14/h6-11,15H,12-13H2,1-5H3,(H,21,25)
InChI key: NLYPGPPPFZOHEM-UHFFFAOYSA-N
SMILES: COC(=O)NC1CN(CC(=O)N(C)C(=C1)c1ccccc1)C(=O)OC(C)(C)C
Systematic name  (3):
  • 1-メチル-2-オキソ-6-[(メトキシカルボニル)アミノ]-8-フェニル-2,3,5,6-テトラヒドロ-1,4-ジアゾシン-4(1H)-カルボン酸tert-ブチル
  • tert-ブチル 7-[(メトキシカルボニル)アミノ]-4-メチル-3-オキソ-5-フェニル-1,2,3,4,7,8-ヘキサヒドロ-1,4-ジアゾシン-1-カルボキシラート
  • tert-butyl 7-[(methoxycarbonyl)amino]-4-methyl-3-oxo-5-phenyl-1,2,3,4,7,8-hexahydro-1,4-diazocine-1-carboxylate
Other name (1):
  • 1-Methyl-2-oxo-6-[(methoxycarbonyl)amino]-8-phenyl-2,3,5,6-tetrahydro-1,4-diazocine-4(1H)-carboxylic acid tert-butyl ester
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