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
COc1ccc(S(=O)(=O)/C=C/C2CCN(Cc3ccccc3)CC2)cc1OC
InChI=1S/C22H27NO4S/c1-26-21-9-8-20(16-22(21)27-2)28(24,25)15-12-18-10-13-23(14-11-18)17-19-6-4-3-5-7-19/h3-9,12,15-16,18H,10-11,13-14,17H2,1-2H3/b15-12+
BFMSOQNGIADECS-NTCAYCPXSA-N
401.53