Home › Resources & tools › IUPAC to SMILES

IUPAC to SMILES

This tool converts IUPAC names to SMILES (simplified molecular-input line-entry system) strings.

Enter or paste a systematic IUPAC name of the molecule and click "Convert" to generate its corresponding SMILES string.

The IUPAC name of the molecule.
The SMILES string of the molecule.

To go from a SMILES string to an IUPAC name, use the SMILES to IUPAC converter.

See also

$19.99

Poster, single-sided.

chemistrybiochemistry
$19.99

Poster, single-sided.

chemistrybiochemistry
$29.99

A systematic, visual guide to the chemical elements.

chemistry
$29.99

A collection of elaborate, large-format chemical structure depictions. Discover the fine details of chemical structures in their own right.

chemistrytypography
$19.99

Poster, single-sided.

chemistry

A curated list of awesome resources on SMILES (simplified molecular-input line-entry system).

Convert SMILES to IUPAC name online.

Visualize the parse tree of a SMILES string.

A pronunciation guide for chemical elements.

A daily crossword puzzle for cheminformatics terms.

A curated list of awesome cheminformatics resources.

View structural formulas of chemical compounds.

View molecular models in 3D.

A pronunciation guide for organic chemistry terms.

An online tool for converting (resolving) InChIKeys to SMILES strings.

A daily crossword puzzle for chemical engineering terms.

A web service for converting SMILES (simplified molecular-input line-entry system) to MOL.

ChemDraw JS makes it possible to create, view, and edit chemical structures in the browser.

Convert SMILES to InChI string online.

Improving the appearance of chemical structures by carefully adjusting the spacing between atoms and bonds.

A daily crossword puzzle for organic chemistry terms.

Convert a SMILES string to its canonical (kekulized) form.

A simple online editor for Mol files.

Convert IUPAC names to 2D structures.

Discover a new molecule every day.

Generate IUPAC multiplicative prefixes for naming chemical compounds.

A daily crossword puzzle for chemical elements.

A pronunciation guide for biochemistry terms.

Convert SMILES (simplified molecular-input line-entry system) to a structure online.

A curated list of awesome ChemDraw resources, tutorials, and more.

A pronunciation guide for terms in supramolecular chemistry.

A pronunciation guide for cheminformatics terms.

All prices listed are in United States Dollars (USD). Visual representations of products are intended for illustrative purposes. Actual products may exhibit variations in color, texture, or other characteristics inherent to the manufacturing process.