1429056-42-7 (((4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt)

快速询单

结构式：

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid saltMOL文件

CAS号：

1429056-42-7

英文名称：

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt

分子式：

C₁₃H₁₉ClN₂O₈S₂

分子量：

430.881560564041

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt(1429056-42-7)名称与标识符

名称

英文别名：

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt;

标识符

InChIKey：

PJEMBBQYHSUKEY-UHFFFAOYSA-N

Inchi：

1S/C13H17ClN2O4S.H2O4S/c1-16-8-6-11(7-9-16)20-13(17)15-10-2-4-12(5-3-10)21(14,18)19;1-5(2,3)4/h2-5,11H,6-9H2,1H3,(H,15,17);(H2,1,2,3,4)

SMILES：

C(OC1CCN(C)CC1)(=O)NC1=CC=C(S(Cl)(=O)=O)C=C1.S(O)(O)(=O)=O

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt(1429056-42-7)物化性质

计算特性

氢键供体数量 : 3
氢键受体数量 : 10
可旋转化学键数量 : 5
重原子数量 : 26

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1429056-42-7 (((4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt)

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt(1429056-42-7)名称与标识符

名称

标识符

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt(1429056-42-7)物化性质

计算特性

(4-Chlorosulfonyl-phenyl)-carbamic acid 1-methyl-piperidin-4-yl ester sulfuric acid salt(1429056-42-7)相关文献

目录