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
CC(C)(CCc1ccc(Cl)cc1)NCC(O)c1ccc(O)c2[nH]c(=O)ccc12.Cl
InChI=1S/C22H25ClN2O3.ClH/c1-22(2,12-11-14-3-5-15(23)6-4-14)24-13-19(27)16-7-9-18(26)21-17(16)8-10-20(28)25-21;/h3-10,19,24,26-27H,11-13H2,1-2H3,(H,25,28);1H
CXVDISMFRJAUDI-UHFFFAOYSA-N
437.37