Papaverine 3D structure

Papaverine (also called Robaxapap, 6,7-Dimethoxy-1-veratrylisoquinoline) has the formula C20H21NO4 and a molar mass of 339.4 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
C20H21NO4
Molar mass
339.4 g/mol
PubChem CID
4680
Heavy atoms
25
Category
Natural products

Explore in 3D Space-filling model PubChem

Identifiers

IUPAC name1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline
SMILESCOC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC
PubChem CID4680
Other namesRobaxapap, 6,7-Dimethoxy-1-veratrylisoquinoline, Pavacap, Papaverinum, Pavatym

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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