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
CCC(c1nc2ccc(Cl)cc2[nH]1)[C@H]1CC[C@@H](c2ccnc3ccc(F)cc32)CC1
InChI=1S/C25H25ClFN3/c1-2-19(25-29-23-9-7-17(26)13-24(23)30-25)15-3-5-16(6-4-15)20-11-12-28-22-10-8-18(27)14-21(20)22/h7-16,19H,2-6H2,1H3,(H,29,30)/t15-,16+,19?
HKXFHHROUCHAPP-MCPYQZEQSA-N
421.95