PROPAN-2-YL 4-(4-HYDROXY-3-NITROPHENYL)-2,7,7-TRIMETHYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE

CAS号
CCD编号
CCD00145764
分子式
C22 H26 N2 O6
分子量
414.455

基本信息

产品名称: PROPAN-2-YL 4-(4-HYDROXY-3-NITROPHENYL)-2,7,7-TRIMETHYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE
英文同义词: PROPAN-2-YL 4-(4-HYDROXY-3-NITROPHENYL)-2,7,7-TRIMETHYL-5-OXO-1,4,5,6,7,8-HEXAHYDROQUINOLINE-3-CARBOXYLATE
MDL号: MFCD00622817
氢键受体数量: 8
氢键供体数量: 2
Smile: CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)c3ccc(c(c3)[N+](=O)[O-])O)C(=O)OC(C)C
InChi: InChI=1S/C22H26N2O6/c1-11(2)30-21(27)18-12(3)23-14-9-22(4,5)10-17(26)20(14)19(18)13-6-7-16(25)15(8-13)24(28)29/h6-8,11,19,23,25H,9-10H2,1-5H3
InChiKey: InChIKey=VBMIRVIKRPHTOE-UHFFFAOYSA-N

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