1-(PHENYLTHIO)CYCLOPENTANECARBOXYLIC ACID 2-(DIMETHYLAMINO)ETHYL ESTER OXALATE

CAS号
101329-93-5
CCD编号
CCD00248592
分子式
C16 H23 N O2 S . C2 H2 O4
分子量
383.462

基本信息

产品名称: 1-(PHENYLTHIO)CYCLOPENTANECARBOXYLIC ACID 2-(DIMETHYLAMINO)ETHYL ESTER OXALATE
CAS: 101329-93-5
英文同义词: 1-(PHENYLTHIO)CYCLOPENTANECARBOXYLIC ACID 2-(DIMETHYLAMINO)ETHYL ESTER OXALATE
MDL号: MFCD01735454
氢键受体数量: 3
氢键供体数量: 0
Smile: CN(C)CCOC(=O)C1(CCCC1)Sc2ccccc2.C(=O)(C(=O)O)O
InChi: InChI=1S/C16H23NO2S.C2H2O4/c1-17(2)12-13-19-15(18)16(10-6-7-11-16)20-14-8-4-3-5-9-14;3-1(4)2(5)6/h3-5,8-9H,6-7,10-13H2,1-2H3;(H,3,4)(H,5,6)
InChiKey: InChIKey=XEOQSJRVIAKPIP-UHFFFAOYSA-N

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