Products 2409055-48-5

CAS 2409055-48-5 is the registry number for Sofpironium (tosylate). Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

[(3R)-1-(2-ethoxy-2-oxoethyl)-1-methylpyrrolidin-1-ium-3-yl] (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate;4-methylbenzenesulfonate (CAS 2409055-48-5) is a chemical compound with the molecular formula C29H39NO8S and a molecular weight of 561.7 g/mol. IUPAC name: [(3R)-1-(2-ethoxy-2-oxoethyl)-1-methylpyrrolidin-1-ium-3-yl] (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate;4-methylbenzenesulfonate. InChIKey: HKOLUULUFDVPNB-JOFREBOKSA-M.

Identity
Molecular formulaC29H39NO8S
Molecular weight561.7 g/mol
IUPAC name[(3R)-1-(2-ethoxy-2-oxoethyl)-1-methylpyrrolidin-1-ium-3-yl] (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate;4-methylbenzenesulfonate
InChIKeyHKOLUULUFDVPNB-JOFREBOKSA-M
SMILESCCOC(=O)C[N+]1(CC[C@H](C1)OC(=O)[C@@](C2CCCC2)(C3=CC=CC=C3)O)C.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Computed by PubChem (NCBI)

Synonyms: orb2802475