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
CCN(CC)c1ccc(-c2cc(-c3ccc(C(=O)O)cc3)ccc2CCCO)cc1C(C)(C)C.Cl
InChI=1S/C30H37NO3.ClH/c1-6-31(7-2)28-17-16-25(20-27(28)30(3,4)5)26-19-24(15-12-22(26)9-8-18-32)21-10-13-23(14-11-21)29(33)34;/h10-17,19-20,32H,6-9,18H2,1-5H3,(H,33,34);1H
XPDSFZHGFFIXFG-UHFFFAOYSA-N
496.09