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
CCc1cc(Cc2ccc(CC(=O)NCCO)cc2)nc(-c2cccc(Cl)c2)n1
InChI=1S/C23H24ClN3O2/c1-2-20-15-21(27-23(26-20)18-4-3-5-19(24)14-18)12-16-6-8-17(9-7-16)13-22(29)25-10-11-28/h3-9,14-15,28H,2,10-13H2,1H3,(H,25,29)
NIRWNBPXDXMYJK-UHFFFAOYSA-N
409.92