Substance
  • Substance Name: paroxetine hydrochloride hemihydrate
  • Formula: C38H44Cl2F2N2O7
  • Molecular Weight: 749.7 g/mol
  • Identifiers:
    • inchi: InChI=1S/2C19H20FNO3.2ClH.H2O/c2*20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18;;;/h2*1-6,9,14,17,21H,7-8,10-12H2;2*1H;1H2/t2*14-,17-;;;/m00.../s1
    • inchikey: MQZOATSIFWSKKT-OASXIEIISA-N
    • casrn: 110429-35-1
    • csmiles: C1CNCC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4.C1CNCC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4.O.Cl.Cl
    • ismiles: C1CNC[C@H]([C@@H]1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4.C1CNC[C@H]([C@@H]1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4.O.Cl.Cl
    • pubchemId: 5282487
    • iupacname: (3S,4R)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine;hydrate;dihydrochloride
    • wikidataId: Q27293431
    • chemspiderId: 4445630
    • ecnumber: 600-962-7
paroxetine hydrochloride hemihydrate
Systems and Datasets