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
CN(Cc1nc2cccc(C(=O)NCCCCN)c2[nH]1)C1CCCc2cccnc21
InChI=1S/C23H30N6O/c1-29(19-11-4-7-16-8-6-14-25-21(16)19)15-20-27-18-10-5-9-17(22(18)28-20)23(30)26-13-3-2-12-24/h5-6,8-10,14,19H,2-4,7,11-13,15,24H2,1H3,(H,26,30)(H,27,28)
LQVUNQPJWCYVCI-UHFFFAOYSA-N
406.53