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=S(=O)(Nc1cc(-c2ccc3c(c2)CCN3)cnc1Cl)c1ccccc1
InChI=1S/C19H16ClN3O2S/c20-19-18(23-26(24,25)16-4-2-1-3-5-16)11-15(12-22-19)13-6-7-17-14(10-13)8-9-21-17/h1-7,10-12,21,23H,8-9H2
PWUUEOCIWNDVEM-UHFFFAOYSA-N
385.88