Escitalopram 3D structure

Escitalopram (also called Cipralex, Seroplex) has the formula C20H21FN2O and a molar mass of 324.4 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
C20H21FN2O
Molar mass
324.4 g/mol
PubChem CID
146570
Heavy atoms
24
Category
Common drugs

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name(1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile
SMILESCN(C)CCC[C@@]1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F
PubChem CID146570
Other namesCipralex, Seroplex, Esertia, Esitol, escitalopramum

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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