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
CCCNc1nc(N(CCO)CCO)nc2c(NCCC)nc(N(CCO)CCO)nc12
InChI=1S/C20H36N8O4/c1-3-5-21-17-15-16(24-19(25-17)27(7-11-29)8-12-30)18(22-6-4-2)26-20(23-15)28(9-13-31)10-14-32/h29-32H,3-14H2,1-2H3,(H,21,24,25)(H,22,23,26)
SCRCUWPMDRPUKB-UHFFFAOYSA-N
452.56