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
Cc1c(CN2CCN(C(=O)C3CCCC3)CC2)cccc1Nc1nc2ccccc2[nH]1
InChI=1S/C25H31N5O/c1-18-20(17-29-13-15-30(16-14-29)24(31)19-7-2-3-8-19)9-6-12-21(18)26-25-27-22-10-4-5-11-23(22)28-25/h4-6,9-12,19H,2-3,7-8,13-17H2,1H3,(H2,26,27,28)
LUALIIOYQYTDHG-UHFFFAOYSA-N
417.56