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 Cc1ccccc1C(=O)NC1CN2CCC1CC2.Cl

InChI InChI=1S/C15H20N2O.ClH/c1-11-4-2-3-5-13(11)15(18)16-14-10-17-8-6-12(14)7-9-17;/h2-5,12,14H,6-10H2,1H3,(H,16,18);1H

InChIKey HBGWOVQMYJAPIX-UHFFFAOYSA-N

Molecular Weight

280.8