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
CCc1nc(N)nc(N)c1Cc1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
InChI=1S/C27H28N4O2/c1-2-23-22(26(28)31-27(29)30-23)15-21-13-14-24(32-17-19-9-5-3-6-10-19)25(16-21)33-18-20-11-7-4-8-12-20/h3-14,16H,2,15,17-18H2,1H3,(H4,28,29,30,31)
GQKDSOZCAWADSW-UHFFFAOYSA-N
440.55