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
Nc1ncc(NCCCO)cc1-c1cncc(Nc2cccc(Cl)c2)n1
InChI=1S/C18H19ClN6O/c19-12-3-1-4-13(7-12)24-17-11-21-10-16(25-17)15-8-14(9-23-18(15)20)22-5-2-6-26/h1,3-4,7-11,22,26H,2,5-6H2,(H2,20,23)(H,24,25)
HWMHBHCITCJTIA-UHFFFAOYSA-N
370.84