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
CC12CC(c3ccoc3)(c3ccoc3)C(c3ccccc31)c1cccc[n+]12.[Cl-]
InChI=1S/C24H20NO2.ClH/c1-23-16-24(17-9-12-26-14-17,18-10-13-27-15-18)22(19-6-2-3-7-20(19)23)21-8-4-5-11-25(21)23;/h2-15,22H,16H2,1H3;1H/q+1;/p-1
AVVXZWFGWAMNDN-UHFFFAOYSA-M
389.88