Chem
J-GLOBAL ID：200907002388895112
Nikkaji number：J1.686.812D
2,2′,2′′-[(1,3,5-Benzenetriyl)triscarbonyl]tris[malonic acid bis(4-methylphenyl)] ester
2,2′,2′′-[(1,3,5-ベンゼントリイル)トリスカルボニル]トリス[マロン酸ビス(4-メチルフェニル)]
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
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
Molecular formula： C60H48O15
Molecular formula furigana： C60-H48-O15
Molecular weight： 1009.029
InChI：
InChI=1S/C60H48O15/c1-34-7-19-43(20-8-34)70-55(64)49(56(65)71-44-21-9-35(2)10-22-44)52(61)40-31-41(53(62)50(57(66)72-45-23-11-36(3)12-24-45)58(67)73-46-25-13-37(4)14-26-46)33-42(32-40)54(63)51(59(68)74-47-27-15-38(5)16-28-47)60(69)75-48-29-17-39(6)18-30-48/h7-33,49-51H,1-6H3
InChI key：
HZEGHMFVEIOTAF-UHFFFAOYSA-N
SMILES：
Cc1ccc(OC(=O)C(C(=O)Oc2ccc(C)cc2)C(=O)c2cc(cc(c2)C(=O)C(C(=O)Oc2ccc(C)cc2)C(=O)Oc2ccc(C)cc2)C(=O)C(C(=O)Oc2ccc(C)cc2)C(=O)Oc2ccc(C)cc2)cc1
Systematic name (3)：
- 2,2′,2′′-[(1,3,5-ベンゼントリイル)トリスカルボニル]トリス[マロン酸ビス(4-メチルフェニル)]
- ビス(4-メチルフェニル) 2-{3,5-ビス[3-(4-メチルフェノキシ)-2-[(4-メチルフェノキシ)カルボニル]-3-オキソプロパノイル]ベンゾイル}プロパンジオアート
- bis(4-methylphenyl) 2-{3,5-bis[3-(4-methylphenoxy)-2-[(4-methylphenoxy)carbonyl]-3-oxopropanoyl]benzoyl}propanedioate
- 2,2′,2′′-[(1,3,5-Benzenetriyl)triscarbonyl]tris[malonic acid bis(4-methylphenyl)] ester
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