Ipratropium 3D structure

Ipratropium (also called Ipratropium ion, Ipratropium cation) has the formula C20H30NO3+ and a molar mass of 332.5 g/mol. The model above is PubChem's computed 3D conformer: drag to rotate, scroll to zoom, and use the measurement tools to read bond lengths and angles.

Formula
C20H30NO3+
Molar mass
332.5 g/mol
PubChem CID
657309
Heavy atoms
24
Category
Common drugs

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name[(1R,5S)-8-methyl-8-propan-2-yl-8-azoniabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate
SMILESCC(C)[N+]1([C@@H]2CC[C@H]1CC(C2)OC(=O)C(CO)C3=CC=CC=C3)C
PubChem CID657309
Other namesIpratropium ion, Ipratropium cation, N-Isopropylatropine, Ipatropium Bromide

How to read the 3D model

Atoms use the standard CPK colors: carbon gray, hydrogen white, oxygen red, nitrogen blue, sulfur yellow. Switch to Spacefill to see the molecule's overall shape and size, or Stick for a clear view of the bonds. Click two atoms in distance mode to measure a bond length in ångströms.

3D coordinates are PubChem's computed conformer, one low-energy shape of the molecule. Flexible molecules can take many other shapes.

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