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(Cc1ccccc1Nc1c(Cl)cccc1Cl)N/N=C1\C(=O)N(Cc2ccccc2)c2ccccc21
InChI=1S/C29H22Cl2N4O2/c30-22-13-8-14-23(31)28(22)32-24-15-6-4-11-20(24)17-26(36)33-34-27-21-12-5-7-16-25(21)35(29(27)37)18-19-9-2-1-3-10-19/h1-16,32H,17-18H2,(H,33,36)/b34-27-
MILFNWMXOQXGFV-YLHCSOALSA-N
529.43