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 CN(C)CCCC1(c2ccc(F)cc2)OCc2ccc3ccccc3c21

InChI

InChI=1S/C23H24FNO/c1-25(2)15-5-14-23(19-10-12-20(24)13-11-19)22-18(16-26-23)9-8-17-6-3-4-7-21(17)22/h3-4,6-13H,5,14-16H2,1-2H3

InChIKey WVTLXWYTYRBLHG-UHFFFAOYSA-N

Molecular Weight

349.45