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
Clc1ccc2c(NCCCN3CCN(CCCN(CC4CC4)N4CCCCC4)CC3)ccnc2c1
InChI=1S/C28H43ClN6/c29-25-8-9-26-27(10-12-31-28(26)22-25)30-11-4-13-32-18-20-33(21-19-32)14-5-17-35(23-24-6-7-24)34-15-2-1-3-16-34/h8-10,12,22,24H,1-7,11,13-21,23H2,(H,30,31)
DKHSYTSVSSAYGF-UHFFFAOYSA-N
499.15