[(1S,2S)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(3-hexoxyphenyl)carbamate,chloride
HIT214319177
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HIT ID: HIT214319177
Cas No: 38198-37-7
分子式: C23H37ClN2O3
分子量: 425.01
常用名: [(1S,2S)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(3-hexoxyphenyl)carbamate,chloride
常用名: [(1S,2S)-2-pyrrolidin-1-ium-1-ylcyclohexyl] N-(3-hexoxyphenyl)carbamate,chloride
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,2R)-2-(pyrrolidin-1-yl)cyclohexyl N-[3-(hexyloxy)phenyl]carbamate hydrochloride
IUPAC: (1R,2R)-2-(pyrrolidin-1-yl)cyclohexyl N-[3-(hexyloxy)phenyl]carbamate hydrochloride
SMILES: Cl.CCCCCCOc1cccc(NC(=O)O[C@@H]2CCCC[C@H]2N2CCCC2)c1
SMILES: Cl.CCCCCCOc1cccc(NC(=O)O[C@@H]2CCCC[C@H]2N2CCCC2)c1
InChI key: XPJPGDIKDDZIHY-HLUKFBSCSA-N
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