Identifier Cleaner

Convert between SMILES, InChI, InChIKey, and compound names. Supports PubChem name resolution as a fallback when the input is a common drug name.

Example: aspirin → CC(=O)Oc1ccccc1C(=O)O

Free Research Context Use this tool freely, then open the research home or demo workspace when you want project context.

Research home Demo workspace

Canonical SMILES Oc1ccc(C23CCCC(CC2)CO3)cc1

InChI InChI=1S/C14H18O2/c15-13-5-3-12(4-6-13)14-8-1-2-11(7-9-14)10-16-14/h3-6,11,15H,1-2,7-10H2

InChIKey SGMNYWKCKCAVKG-UHFFFAOYSA-N

Molecular Weight

218.3