肉桂基苄基哌啶基乙氧基丙基苯甲酰胺 cinnamido benzylpiperidinyl ethoxypropylbenzamide
右键点击后面的免费Jmol Molecule链接获取更多信息 Right Click Free Jmol Molecule For More Options. 戳 Click 这里 Here.
iupac名称 IUPAC Name :2-（4-苄基哌啶-1-基）-正-（3-乙氧基丙基）-5-[[（（e）-3-苯基丙-2-烯酰基]氨基]苯甲酰胺 2-(4-benzylpiperidin-1-yl)-N-(3-ethoxypropyl)-5-[[(E)-3-phenylprop-2-enoyl]amino]benzamide
INCHI InChI :INCHI InChI=1/C33H39N3O3/c1-2-39-23-9-20-34-33(38)30-25-29(35-32(37)17-14-26-10-5-3-6-11-26)15-16-31(30)36-21-18-28(19-22-36)24-27-12-7-4-8-13-27/h3-8,10-17,25,28H,2,9,18-24H2,1h3 1H3,(H,34,38)(H,35,37)/b17-14+
印地 Std.InChI: INCHI InChI=1S/C33H39N3O3/c1-2-39-23-9-20-34-33(38)30-25-29(35-32(37)17-14-26-10-5-3-6-11-26)15-16-31(30)36-21-18-28(19-22-36)24-27-12-7-4-8-13-27/h3-8,10-17,25,28H,2,9,18-24H2,1h3 1H3,(H,34,38)(H,35,37)/b17-14+
INCHI基 InChIKey :WLBVNLFUCUVTLE-SAPNQHFABL
标准奇奇 Std.InChIKey: WLBVNLFUCUVTLE-SAPNQHFASA-N
微笑 SMILES :CCOCCC数控 NC(= o =O)C1=C(c = cc c = c C=CC(=C1)数控 NC(= o =O)/c = c C=C/C2=Cc = cc c = c C=Cc = c C=C2)N3CCC(CC3)CC4=Cc = cc c = c C=Cc = c C=C4
磨牙 Molar 折射率 Refractivity :157.41 ± 0.5 cm3 (估 est)
Parachor :1205.9 ± 8.0 cm3 (估 est)
折射率 Index of Refraction :1.585 ± 0.05
(估 est)
表面张力 Surface Tension :43.5 ± 7.0 dyne/cm (估 est)
密度 Density :1.11 ± 0.1 g/cm3 (估 est)
极化率 Polarizability :62.40 ± 0.5 10-24cm3 (估 est)