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Substance Name: Ipratropium bromide [USAN:USP:INN:BAN:JAN]
RN: 66985-17-9
UNII: J697UZ2A9J
InChIKey: KEWHKYJURDBRMN-XSAPEOHZSA-M

Classification Code

  • Bronchodilator

Molecular Formula

  • C20-H30-Br-N-O3.x-H2-O

Molecular Weight

  • 430.3798
 

Names and Synonyms

Name of Substance

  • Ipratropium bromide [USAN:USP:INN:BAN:JAN]

Synonyms

  • (8r)-3alpha-Hydroxy-8-isopropyl-1alphaH,5alphaH-tropanium bromide (+-)-tropate monohydrate
  • Atrovent
  • Ipratropium bromide
  • Ipratropium bromide hydrate
  • Sch 1000-Br-monohydrate
  • UNII-J697UZ2A9J

Systematic Name

  • 8-Azoniabicyclo(3.2.1)octane, 3-(3-hydroxy-1-oxo-2-phenylpropoxy)-8-methyl-8-(1-methylethyl)-, bromide, monohydrate(endo, syn)-, (+-)-

Registry Numbers

CAS Registry Number

  • 66985-17-9

FDA UNII

  • J697UZ2A9J

System Generated Number

  • 0066985179

Molecular Formulas

Molecular Formula

  • C20-H30-Br-N-O3.x-H2-O

Molecular Formula Fragments

  • C20-H30-Br-N-O3
  • H2-O

Structure Descriptors

InChI

1S/C20H30NO3.BrH.H2O/c1-14(2)21(3)16-9-10-17(21)12-18(11-16)24-20(23)19(13-22)15-7-5-4-6-8-15;;/h4-8,14,16-19,22H,9-13H2,1-3H3;1H;1H2/q+1;;/p-1/t16-,17+,18+,19?,21?;;

InChIKey

KEWHKYJURDBRMN-XSAPEOHZSA-M

Smiles

CC(C)[N+]1([C@@H]2CC[C@H]1C[C@H](C2)OC(=O)C(CO)c3ccccc3)C.O.[Br-]