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
c1ccc(CNCc2ccc(CN(Cc3cc4ccccc4[nH]3)C3CCCc4cccnc43)cc2)nc1
InChI=1S/C32H33N5/c1-2-11-30-27(7-1)19-29(36-30)23-37(31-12-5-8-26-9-6-18-35-32(26)31)22-25-15-13-24(14-16-25)20-33-21-28-10-3-4-17-34-28/h1-4,6-7,9-11,13-19,31,33,36H,5,8,12,20-23H2
IEWXODVRBFFDRL-UHFFFAOYSA-N
487.65