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
C[n+]1c(/C=C2\C=CN(CC(=O)NCCN3CCCCC3)c3ccccc32)sc2ccccc21
InChI=1S/C27H30N4OS/c1-29-24-11-5-6-12-25(24)33-27(29)19-21-13-17-31(23-10-4-3-9-22(21)23)20-26(32)28-14-18-30-15-7-2-8-16-30/h3-6,9-13,17,19H,2,7-8,14-16,18,20H2,1H3/p+1
DHJAUOUQXUYSNZ-UHFFFAOYSA-O
459.64