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
NS(=O)(=O)c1cc(C(=O)NCCCO)c(S(=O)(=O)C2CCCCC2)cc1Cl
InChI=1S/C16H23ClN2O6S2/c17-13-10-14(26(22,23)11-5-2-1-3-6-11)12(9-15(13)27(18,24)25)16(21)19-7-4-8-20/h9-11,20H,1-8H2,(H,19,21)(H2,18,24,25)
ZFSZIAIBGKCABH-UHFFFAOYSA-N
438.96