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
CCc1cc(Oc2c(I)cc(CC3NC(=O)NC3=O)cc2I)ccc1O
InChI=1S/C18H16I2N2O4/c1-2-10-8-11(3-4-15(10)23)26-16-12(19)5-9(6-13(16)20)7-14-17(24)22-18(25)21-14/h3-6,8,14,23H,2,7H2,1H3,(H2,21,22,24,25)
HCNAVNKQMIVZML-UHFFFAOYSA-N
578.14