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
O=C(Nc1ccc(-c2cccnc2)cc1)Nc1cc(Br)ccc1OC(F)(F)F
InChI=1S/C19H13BrF3N3O2/c20-14-5-8-17(28-19(21,22)23)16(10-14)26-18(27)25-15-6-3-12(4-7-15)13-2-1-9-24-11-13/h1-11H,(H2,25,26,27)
PPXGMDGUQGHNEP-UHFFFAOYSA-N
452.23