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
CCN(CCCCCCn1nc(-c2ccccc2O)ccc1=O)Cc1ccccc1F
InChI=1S/C25H30FN3O2/c1-2-28(19-20-11-5-7-13-22(20)26)17-9-3-4-10-18-29-25(31)16-15-23(27-29)21-12-6-8-14-24(21)30/h5-8,11-16,30H,2-4,9-10,17-19H2,1H3
ZTMCMBCNPPCAIO-UHFFFAOYSA-N
423.53