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
CCCc1nc(C)n2nc(C)nc2c1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
InChI=1S/C24H24N8/c1-4-7-22-21(24-25-15(2)29-32(24)16(3)26-22)14-17-10-12-18(13-11-17)19-8-5-6-9-20(19)23-27-30-31-28-23/h5-6,8-13H,4,7,14H2,1-3H3,(H,27,28,30,31)
DSRBYBWAYNAFOZ-UHFFFAOYSA-N
424.51