4-BR-2-(2-((4-ETHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE

CAS号
769150-25-6
CCD编号
CCD00487776
分子式
C25 H22 Br N3 O6
分子量
540.368

基本信息

产品名称: 4-BR-2-(2-((4-ETHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
CAS: 769150-25-6
英文同义词: 4-BR-2-(2-((4-ETHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-METHOXYBENZOATE
MDL号: MFCD05153980
氢键受体数量: 9
氢键供体数量: 2
Smile: CCOc1ccc(cc1)NC(=O)C(=O)N/N=C/c2cc(ccc2OC(=O)c3ccc(cc3)OC)Br
InChi: InChI=1S/C25H22BrN3O6/c1-3-34-21-11-7-19(8-12-21)28-23(30)24(31)29-27-15-17-14-18(26)6-13-22(17)35-25(32)16-4-9-20(33-2)10-5-16/h4-15H,3H2,1-2H3,(H,28,30)(H,29,31)/b27-15+
InChiKey: InChIKey=NBYCWLOCBCZLMM-JFLMPSFJSA-N

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