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 CCCN(CCC)C1CCC(=CC#N)CC1

InChI InChI=1S/C14H24N2/c1-3-11-16(12-4-2)14-7-5-13(6-8-14)9-10-15/h9,14H,3-8,11-12H2,1-2H3

InChIKey FMKZTRTUGPXJFV-UHFFFAOYSA-N

Molecular Weight

220.36