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
FC1(F)CCCC1Nc1nc(NC2CCCC2(F)F)nc(-c2cccc(Cl)n2)n1
InChI=1S/C18H19ClF4N6/c19-13-7-1-4-10(24-13)14-27-15(25-11-5-2-8-17(11,20)21)29-16(28-14)26-12-6-3-9-18(12,22)23/h1,4,7,11-12H,2-3,5-6,8-9H2,(H2,25,26,27,28,29)
PDSKCDIBFYQGCE-UHFFFAOYSA-N
430.84