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
O=C(O)/C=C/c1ccc(Oc2c(C(=O)c3ccc4ccccc4c3)sc3cc(F)ccc23)cc1
InChI=1S/C28H17FO4S/c29-21-10-13-23-24(16-21)34-28(26(32)20-9-8-18-3-1-2-4-19(18)15-20)27(23)33-22-11-5-17(6-12-22)7-14-25(30)31/h1-16H,(H,30,31)/b14-7+
JOYCKTMOUDUAFJ-VGOFMYFVSA-N
468.51