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
O=C(CCNC1CCCCC1)NC(c1ccccc1)C1CCCCC1
InChI=1S/C22H34N2O/c25-21(16-17-23-20-14-8-3-9-15-20)24-22(18-10-4-1-5-11-18)19-12-6-2-7-13-19/h1,4-5,10-11,19-20,22-23H,2-3,6-9,12-17H2,(H,24,25)
BTKGKYBZHPQSBM-UHFFFAOYSA-N
342.53