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
CCCCn1nc(C)c(C=O)c1Cc1ccc(-c2ccccc2-c2nn[nH]n2)cc1
InChI=1S/C23H24N6O/c1-3-4-13-29-22(21(15-30)16(2)26-29)14-17-9-11-18(12-10-17)19-7-5-6-8-20(19)23-24-27-28-25-23/h5-12,15H,3-4,13-14H2,1-2H3,(H,24,25,27,28)
HGOSFEKMGFXCPD-UHFFFAOYSA-N
400.49