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
CC(CC#N)NCC(O)COc1ccc(CCOCC2CCC2)cc1.Cl
InChI=1S/C20H30N2O3.ClH/c1-16(9-11-21)22-13-19(23)15-25-20-7-5-17(6-8-20)10-12-24-14-18-3-2-4-18;/h5-8,16,18-19,22-23H,2-4,9-10,12-15H2,1H3;1H
LHBYKRFRTJEKMG-UHFFFAOYSA-N
382.93