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
C#CCN(Cc1ccc2nc(C)nc(O)c2c1)c1cccc(CO)c1
InChI=1S/C20H19N3O2/c1-3-9-23(17-6-4-5-16(10-17)13-24)12-15-7-8-19-18(11-15)20(25)22-14(2)21-19/h1,4-8,10-11,24H,9,12-13H2,2H3,(H,21,22,25)
LLPXTZCJCHQBHT-UHFFFAOYSA-N
333.39