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
CCCc1ccc(C2CC(c3ccc(CN4CC(C(=O)O)C4)cc3)=NO2)cc1
InChI=1S/C23H26N2O3/c1-2-3-16-4-10-19(11-5-16)22-12-21(24-28-22)18-8-6-17(7-9-18)13-25-14-20(15-25)23(26)27/h4-11,20,22H,2-3,12-15H2,1H3,(H,26,27)
PWBIUNCFDILYDF-UHFFFAOYSA-N
378.47