Chem
J-GLOBAL ID:201807006597106511   Nikkaji number:J3.685.834F

Bis(octadecylcarbamic acid)13,20-bis(methoxymethyl)cyclotetracosa-1,7,13,19-tetraene-3,5,9,11,15,17,21,23-octayne-1,8-diylbismethylene ester

ビス(オクタデシルカルバミド酸)13,20-ビス(メトキシメチル)シクロテトラコサ-1,7,13,19-テトラエン-3,5,9,11,15,17,21,23-オクタイン-1,8-ジイルビスメチレン
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: C68H94N2O6
Molecular formula furigana: C68-H94-N2-O6
Molecular weight: 1035.508
InChI: InChI=1S/C68H94N2O6/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-47-57-69-67(71)75-61-65-51-41-35-36-42-52-66(56-46-44-54-64(60-74-4)50-40-34-33-39-49-63(59-73-3)53-43-45-55-65)62-76-68(72)70-58-48-38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h49-52H,5-32,37-38,47-48,57-62H2,1-4H3,(H,69,71)(H,70,72)
InChI key: APZYIUMGSWHXGD-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCCCCNC(=O)OCC1=CC#CC#CC=C(COC(=O)NCCCCCCCCCCCCCCCCCC)C#CC#CC(=CC#CC#CC=C(COC)C#CC#C1)COC
Systematic name  (3):
  • ビス(オクタデシルカルバミド酸)13,20-ビス(メトキシメチル)シクロテトラコサ-1,7,13,19-テトラエン-3,5,9,11,15,17,21,23-オクタイン-1,8-ジイルビスメチレン
  • [13,20-ビス(メトキシメチル)-8-{[(オクタデシルカルバモイル)オキシ]メチル}シクロテトラコサ-1,7,13,19-テトラエン-3,5,9,11,15,17,21,23-オクタイン-1-イル]メチル N-オクタデシルカルバマート
  • [13,20-bis(methoxymethyl)-8-{[(octadecylcarbamoyl)oxy]methyl}cyclotetracosa-1,7,13,19-tetraen-3,5,9,11,15,17,21,23-octayn-1-yl]methyl N-octadecylcarbamate
Other name (1):
  • Bis(octadecylcarbamic acid)13,20-bis(methoxymethyl)cyclotetracosa-1,7,13,19-tetraene-3,5,9,11,15,17,21,23-octayne-1,8-diylbismethylene ester
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