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
CSc1nnc(-c2ccc(CNC(=O)Nc3ccc([N+](=O)[O-])cc3)nc2C)o1
InChI=1S/C17H16N6O4S/c1-10-14(15-21-22-17(27-15)28-2)8-5-12(19-10)9-18-16(24)20-11-3-6-13(7-4-11)23(25)26/h3-8H,9H2,1-2H3,(H2,18,20,24)
BLKGZWLRUDQELC-UHFFFAOYSA-N
400.42