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
COc1ccc2nc3cc(Cl)ccc3c(Nc3ccc(CN4CCN(C)CC4)cc3)c2c1
InChI=1S/C26H27ClN4O/c1-30-11-13-31(14-12-30)17-18-3-6-20(7-4-18)28-26-22-9-5-19(27)15-25(22)29-24-10-8-21(32-2)16-23(24)26/h3-10,15-16H,11-14,17H2,1-2H3,(H,28,29)
LMHFMSSXSUQOKY-UHFFFAOYSA-N
446.98