4-((2-METHOXY-4-[(1-(4-METHOXYPHENYL)-2,4,6-TRIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]PHENOXY)METHYL)BENZOIC ACID

CAS号
CCD编号
CCD00283269
分子式
C27 H22 N2 O8
分子量
502.477

基本信息

产品名称: 4-((2-METHOXY-4-[(1-(4-METHOXYPHENYL)-2,4,6-TRIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]PHENOXY)METHYL)BENZOIC ACID
英文同义词: 4-((2-METHOXY-4-[(1-(4-METHOXYPHENYL)-2,4,6-TRIOXOTETRAHYDRO-5(2H)-PYRIMIDINYLIDENE)METHYL]PHENOXY)METHYL)BENZOIC ACID
MDL号: MFCD02085138
氢键受体数量: 10
氢键供体数量: 2
Smile: COc1ccc(cc1)N2C(=O)/C(=C/c3ccc(c(c3)OC)OCc4ccc(cc4)C(=O)O)/C(=O)NC2=O
InChi: InChI=1S/C27H22N2O8/c1-35-20-10-8-19(9-11-20)29-25(31)21(24(30)28-27(29)34)13-17-5-12-22(23(14-17)36-2)37-15-16-3-6-18(7-4-16)26(32)33/h3-14H,15H2,1-2H3,(H,32,33)(H,28,30,34)/b21-13+
InChiKey: InChIKey=OTPNJEIYSANAED-FYJGNVAPSA-N

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