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
COc1ccc(-c2cc(C(F)(F)F)cn3nc(NC(=O)C4CC4)nc23)cc1
InChI=1S/C18H15F3N4O2/c1-27-13-6-4-10(5-7-13)14-8-12(18(19,20)21)9-25-15(14)22-17(24-25)23-16(26)11-2-3-11/h4-9,11H,2-3H2,1H3,(H,23,24,26)
CZJFIIBCGOBACK-UHFFFAOYSA-N
376.34