8,8-BIS((2-CARBOXYETHOXY)METHYL)-3,6-DIOXO-1-PHENYL-2,10-DIOXA-4,7-DIAZATRIDECAN-13-OIC ACID

CAS号
220886-02-2
CCD编号
CCD04011934
分子式
C23 H32 N2 O12
分子量
528.508

基本信息

产品名称: 8,8-BIS((2-CARBOXYETHOXY)METHYL)-3,6-DIOXO-1-PHENYL-2,10-DIOXA-4,7-DIAZATRIDECAN-13-OIC ACID
CAS: 220886-02-2
英文同义词: 8,8-BIS((2-CARBOXYETHOXY)METHYL)-3,6-DIOXO-1-PHENYL-2,10-DIOXA-4,7-DIAZATRIDECAN-13-OIC ACID
MDL号: MFCD18252296
氢键受体数量: 14
氢键供体数量: 5
Smile: c1ccc(cc1)COC(=O)NCC(=O)NC(COCCC(=O)O)(COCCC(=O)O)COCCC(=O)O
InChi: InChI=1S/C23H32N2O12/c26-18(12-24-22(33)37-13-17-4-2-1-3-5-17)25-23(14-34-9-6-19(27)28,15-35-10-7-20(29)30)16-36-11-8-21(31)32/h1-5H,6-16H2,(H,24,33)(H,25,26)(H,27,28)(H,29,30)(H,31,32)
InChiKey: InChIKey=XMIQEIHGYZQFEO-UHFFFAOYSA-N

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