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 C[C@@H](C1CCCCC1)N(C)Cc1cc2ccccc2[nH]1

InChI

InChI=1S/C18H26N2/c1-14(15-8-4-3-5-9-15)20(2)13-17-12-16-10-6-7-11-18(16)19-17/h6-7,10-12,14-15,19H,3-5,8-9,13H2,1-2H3/t14-/m0/s1

InChIKey UKIMHUAMNKODDM-AWEZNQCLSA-N

Molecular Weight

270.42