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
COc1ccc(C)cc1C1(C(=O)NS(=O)(=O)c2cccc3nc(C)ccc23)CC1c1cccc(C(F)F)n1
InChI=1S/C28H25F2N3O4S/c1-16-10-13-24(37-3)19(14-16)28(15-20(28)22-7-4-8-23(32-22)26(29)30)27(34)33-38(35,36)25-9-5-6-21-18(25)12-11-17(2)31-21/h4-14,20,26H,15H2,1-3H3,(H,33,34)
DFQBJQIHQMYWTB-UHFFFAOYSA-N
537.59