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
O=C(Cn1c(Cl)cnc(NCC(F)(F)c2ccccn2)c1=O)NCc1ccccc1-n1ccnc1
InChI=1S/C23H20ClF2N7O2/c24-19-12-30-21(31-14-23(25,26)18-7-3-4-8-28-18)22(35)33(19)13-20(34)29-11-16-5-1-2-6-17(16)32-10-9-27-15-32/h1-10,12,15H,11,13-14H2,(H,29,34)(H,30,31)
QUHSAKGYUHNBMV-UHFFFAOYSA-N
499.91