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
Cc1cc([C@@H](C)Nc2ccccc2C(=O)O)c2nc(N3CC(F)(F)C3)c(C#N)c(=O)n2c1
InChI=1S/C22H19F2N5O3/c1-12-7-15(13(2)26-17-6-4-3-5-14(17)21(31)32)19-27-18(28-10-22(23,24)11-28)16(8-25)20(30)29(19)9-12/h3-7,9,13,26H,10-11H2,1-2H3,(H,31,32)/t13-/m1/s1
LCNRPMQEUCEJRM-CYBMUJFWSA-N
439.42