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
CCCCCCCCCCCC(=O)C(C)C(=O)Nc1c(OC)cc(OC)cc1OC
InChI=1S/C24H39NO5/c1-6-7-8-9-10-11-12-13-14-15-20(26)18(2)24(27)25-23-21(29-4)16-19(28-3)17-22(23)30-5/h16-18H,6-15H2,1-5H3,(H,25,27)
QKNJYFOZFPSDTB-UHFFFAOYSA-N
421.58