Anton
V.
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cheminformatics
SMILES Parse Tree Viewer
SMILES Parse Tree Viewer
SMILES string
NCC(=O)O
1
NCC(=O)O
Parse tree
R
smiles:Smiles
R
chain:Chain
R
branched_atom:Branched_atom
R
atom:Atom
R
aliphatic_organic:Aliphatic_organic
T
UN:"N"
R
branched_atom:Branched_atom
R
atom:Atom
R
aliphatic_organic:Aliphatic_organic
T
UC:"C"
R
branched_atom:Branched_atom
R
atom:Atom
R
aliphatic_organic:Aliphatic_organic
T
UC:"C"
R
branch:Branch
T
"("
R
bond:Bond
T
"="
R
chain:Chain
R
branched_atom:Branched_atom
R
atom:Atom
R
aliphatic_organic:Aliphatic_organic
T
UO:"O"
T
")"
R
branched_atom:Branched_atom
R
atom:Atom
R
aliphatic_organic:Aliphatic_organic
T
UO:"O"
T
"<EOF>"
SMILES Parse Tree Viewer
See also
SMILES to Structure
- Convert SMILES (simplified molecular-input line-entry system) to a structure online.
SMILES to Structure API
- A web service for converting SMILES (simplified molecular-input line-entry system) to MOL.
Canonical SMILES Generator
- Convert a SMILES string to its canonical (kekulized) form.
SMILES to IUPAC
- Convert SMILES to IUPAC name online.
IUPAC to SMILES
- Convert IUPAC names to SMILES strings.
SMILES to InChI
- Convert SMILES to InChI string online.
InChIKey to SMILES
- An online tool for converting (resolving) InChIKeys to SMILES strings.
SMILES to 3D Structure (SMILES to Conformer)
- Convert SMILES (simplified molecular-input line-entry system) to a 3D structure online.
Awesome SMILES
- A curated list of awesome links, tutorials, and resources on SMILES (simplified molecular-input line-entry system).
IUPAC to Structure
- Convert IUPAC names to 2D structures.
Cheminformatics Crossword
- A daily crossword puzzle for cheminformatics terms.
Mol Editor
- A simple online editor for Mol files.
Awesome cheminformatics
- A curated list of awesome cheminformatics resources.
Molecule of the Day
- Discover a new molecule every day.
IUPAC Multiplicative Prefix Generator
- Generate IUPAC multiplicative prefixes for naming chemical compounds.
Structural Formula Viewer
- View structural formulas of chemical compounds.
3D Mol Viewer
- View molecular models in 3D.
Working with ChemDraw JS
- ChemDraw JS makes it possible to create, view, and edit chemical structures in the browser.
JSmol
- What is JSmol and how to use it?
Awesome ChemDraw
- A curated list of awesome ChemDraw resources, tutorials, and more.
Awesome cheminformatics blogs
- A curated list of awesome cheminformatics blogs.
Periodic Table Crossword
- A daily crossword puzzle for chemical elements.
Chemical Engineering Crossword
- A daily crossword puzzle for chemical engineering terms.
Organic Chemistry Crossword
- A daily crossword puzzle for organic chemistry terms.
Made by Anton Vasetenkov in Auckland, New Zealand.
Email
me if you want to discuss a project.