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
Cc1ccc(C(C(=O)NCCCN2C(C)CCCC2C)c2ccc(C)cc2)cc1
InChI=1S/C26H36N2O/c1-19-9-13-23(14-10-19)25(24-15-11-20(2)12-16-24)26(29)27-17-6-18-28-21(3)7-5-8-22(28)4/h9-16,21-22,25H,5-8,17-18H2,1-4H3,(H,27,29)
DZJSRGDCPYFRRD-UHFFFAOYSA-N
392.59