Acetylethylcholine mustard
HIT212714370
sdf文件结构编辑类似物检索
HIT ID: HIT212714370
Cas No: 98812-27-2
分子式: C8H16ClNO2
分子量: 193.67
常用名: Acetylethylcholine mustard
氢键受体数 (HBA): 2
氢键供体数 (HBD): 0
LogP: 0.9624907
IUPAC: 2-[(2-chloroethyl)(ethyl)amino]ethyl acetate
IUPAC: 2-[(2-chloroethyl)(ethyl)amino]ethyl acetate
SMILES: CCN(CCCl)CCOC(C)=O
SMILES: CCN(CCCl)CCOC(C)=O
InChI key: UNAXSEJHNLEOKE-UHFFFAOYSA-N
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