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
COCc1nn(-c2cc(Cl)c(Oc3cc(C(C)C)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
InChI=1S/C18H17Cl2N5O5/c1-8(2)10-6-14(22-23-16(10)26)30-15-11(19)4-9(5-12(15)20)25-18(28)21-17(27)13(24-25)7-29-3/h4-6,8H,7H2,1-3H3,(H,23,26)(H,21,27,28)
FMFUMKJUCACHRH-UHFFFAOYSA-N
454.27