Chem
J-GLOBAL ID:200907050146910227   Nikkaji number:J150.718D

1,1′-(Naphthalene-1,8-diyl)bis(1H-1,2,3-triazole-4,5-dicarboxylic acid diethyl) ester

1,1′-(ナフタレン-1,8-ジイル)ビス(1H-1,2,3-トリアゾール-4,5-ジカルボン酸ジエチル)
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: C26H26N6O8
Molecular formula furigana: C26-H26-N6-O8
Molecular weight: 550.528
InChI: InChI=1S/C26H26N6O8/c1-5-37-23(33)19-21(25(35)39-7-3)31(29-27-19)16-13-9-11-15-12-10-14-17(18(15)16)32-22(26(36)40-8-4)20(28-30-32)24(34)38-6-2/h9-14H,5-8H2,1-4H3
InChI key: HJVVMCWGYRNCKI-UHFFFAOYSA-N
SMILES: CCOC(=O)c1nnn(c1C(=O)OCC)c1cccc2cccc(n3nnc(C(=O)OCC)c3C(=O)OCC)c12
Systematic name  (3):
  • 1,1′-(ナフタレン-1,8-ジイル)ビス(1H-1,2,3-トリアゾール-4,5-ジカルボン酸ジエチル)
  • 4,5-ジエチル 1-{8-[4,5-ビス(エトキシカルボニル)-1H-1,2,3-トリアゾール-1-イル]ナフタレン-1-イル}-1H-1,2,3-トリアゾール-4,5-ジカルボキシラート
  • 4,5-diethyl 1-{8-[4,5-bis(ethoxycarbonyl)-1H-1,2,3-triazol-1-yl]naphthalen-1-yl}-1H-1,2,3-triazole-4,5-dicarboxylate
Other name (1):
  • 1,1′-(Naphthalene-1,8-diyl)bis(1H-1,2,3-triazole-4,5-dicarboxylic acid diethyl) ester
CAS registry number: 91165-62-7
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