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
CCCCc1nc2cccc(NC(C)=O)c2n1Cc1ccc(-c2ccccc2C(=O)O)cc1
InChI=1S/C27H27N3O3/c1-3-4-12-25-29-24-11-7-10-23(28-18(2)31)26(24)30(25)17-19-13-15-20(16-14-19)21-8-5-6-9-22(21)27(32)33/h5-11,13-16H,3-4,12,17H2,1-2H3,(H,28,31)(H,32,33)
OUIPQXNKYCCYKN-UHFFFAOYSA-N
441.53