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
Oc1nc2ccc(C#CCN3CCC(Cc4ccc(F)cc4)CC3)cc2o1
InChI=1S/C22H21FN2O2/c23-19-6-3-17(4-7-19)14-18-9-12-25(13-10-18)11-1-2-16-5-8-20-21(15-16)27-22(26)24-20/h3-8,15,18H,9-14H2,(H,24,26)
NEZKTKYSEMYPIK-UHFFFAOYSA-N
364.42