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
CC1(C(=O)Nc2ncc[nH]2)CC2c3ccccc3C1c1ccccc12
InChI=1S/C21H19N3O/c1-21(19(25)24-20-22-10-11-23-20)12-17-13-6-2-4-8-15(13)18(21)16-9-5-3-7-14(16)17/h2-11,17-18H,12H2,1H3,(H2,22,23,24,25)
SPRNBEPBURHNIM-UHFFFAOYSA-N
329.4