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
CCOc1cccc(-c2cccc(COc3cc(OC)c(CNCCNC(C)=O)c(OC)c3)c2C)c1
InChI=1S/C29H36N2O5/c1-6-35-24-11-7-9-22(15-24)26-12-8-10-23(20(26)2)19-36-25-16-28(33-4)27(29(17-25)34-5)18-30-13-14-31-21(3)32/h7-12,15-17,30H,6,13-14,18-19H2,1-5H3,(H,31,32)
HUDCMLVCJUTNQL-UHFFFAOYSA-N
492.62