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 CCCCCN1CCN(c2cccc(Cl)c2)CC1

InChI InChI=1S/C15H23ClN2/c1-2-3-4-8-17-9-11-18(12-10-17)15-7-5-6-14(16)13-15/h5-7,13H,2-4,8-12H2,1H3

InChIKey UAZUOYAUJDOLHA-UHFFFAOYSA-N

Molecular Weight

266.82