HIT ID: HIT219136779
Cas No: 2409055-48-5
分子式: C29H39NO8S
分子量: 561.69
常用名: Sofpironium tosylate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3R)-3-{[(2R)-2-cyclopentyl-2-hydroxy-2-phenylacetyl]oxy}-1-(2-ethoxy-2-oxoethyl)-1-methylpyrrolidin-1-ium 4-methylbenzene-1-sulfonate
IUPAC: (3R)-3-{[(2R)-2-cyclopentyl-2-hydroxy-2-phenylacetyl]oxy}-1-(2-ethoxy-2-oxoethyl)-1-methylpyrrolidin-1-ium 4-methylbenzene-1-sulfonate
SMILES: Cc1ccc(cc1)S([O-])(=O)=O.CCOC(=O)C[N+]1(C)CC[C@H](C1)OC(=O)[C@@](O)(C1CCCC1)c1ccccc1
SMILES: Cc1ccc(cc1)S([O-])(=O)=O.CCOC(=O)C[N+]1(C)CC[C@H](C1)OC(=O)[C@@](O)(C1CCCC1)c1ccccc1
InChI key: HKOLUULUFDVPNB-JOFREBOKSA-M
