Chem
J-GLOBAL ID:200907019578330260
Nikkaji number:J1.504.546I
5,5′,5′′-[(1,3,5-Benzenetriyl)trismethylenetrisoxy]tris(isophthalic acid dimethyl) ester
5,5′,5′′-[(1,3,5-ベンゼントリイル)トリスメチレントリスオキシ]トリス(イソフタル酸ジメチル)
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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:
C39 H36 O15
Molecular formula furigana:
C39-H36-O15
Molecular weight:
744.702
InChI:
InChI=1S/C39H36O15/c1-46-34(40)25-10-26(35(41)47-2)14-31(13-25)52-19-22-7-23(20-53-32-15-27(36(42)48-3)11-28(16-32)37(43)49-4)9-24(8-22)21-54-33-17-29(38(44)50-5)12-30(18-33)39(45)51-6/h7-18H,19-21H2,1-6H3
InChI key:
CSEKAYYLAOICCN-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(OCc2cc(COc3cc(cc(c3)C(=O)OC)C(=O)OC)cc(COc3cc(cc(c3)C(=O)OC)C(=O)OC)c2)cc(c1)C(=O)OC
Systematic name (3):
5,5′,5′′-[(1,3,5-ベンゼントリイル)トリスメチレントリスオキシ]トリス(イソフタル酸ジメチル)
1,3-ジメチル 5-{[3,5-ビス({[3,5-ビス(メトキシカルボニル)フェノキシ]メチル})フェニル]メトキシ}ベンゼン-1,3-ジカルボキシラート
1,3-dimethyl 5-{[3,5-bis({[3,5-bis(methoxycarbonyl)phenoxy]methyl})phenyl]methoxy}benzene-1,3-dicarboxylate
Other name (1):
5,5′,5′′-[(1,3,5-Benzenetriyl)trismethylenetrisoxy]tris(isophthalic acid dimethyl) ester
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