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(Cn2cc(C(=O)NCCc3ccc(O)cc3)nn2)cc1Br
InChI=1S/C19H19BrN4O3/c1-27-18-7-4-14(10-16(18)20)11-24-12-17(22-23-24)19(26)21-9-8-13-2-5-15(25)6-3-13/h2-7,10,12,25H,8-9,11H2,1H3,(H,21,26)
XUAGBVLGSOMTNI-UHFFFAOYSA-N
431.29