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
CCC(=O)NC1CCN(CCCN2C(=O)CCc3cc(F)ccc32)CC1
InChI=1S/C20H28FN3O2/c1-2-19(25)22-17-8-12-23(13-9-17)10-3-11-24-18-6-5-16(21)14-15(18)4-7-20(24)26/h5-6,14,17H,2-4,7-13H2,1H3,(H,22,25)
YDLVCTMUPUAPOH-UHFFFAOYSA-N
361.46